4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one

C336H434F22O108 — CID 158638107

IUPAC4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one
SMILESC=C(C)C(=O)OCC1CC(=O)O1.C=C(C)C(=O)OCC=CC(=O)O.C=CCCCCC1CC(=O)O1.C=CCCCCC=CC(=O)O.C=CCOCC1CC(=O)O1.C=CCOCC=CC(=O)O.CC1CC(=O)O1.CC=CC(=O)O.CCCC(=O)OCC/C=C/C(=O)O.CCCC(=O)OCC1CC(=O)O1.CCCC(=O)OCC=CC(=O)O.CCCC(=O)OCCC1CC(=O)O1.CCCC(=O)OCCCC1CC(=O)O1.CCCC(=O)OCCCC=CC(=O)O.CCCCCC(O)CC1CC(=O)O1.CCCCCC(O)CC=CC(=O)O.CCCCCC1CC(=O)O1.CCCCCC=CC(=O)O.COc1ccc(CC2CC(=O)O2)cc1.COc1ccc(CC=CC(=O)O)cc1.O=C(O)C=CC1CCCCC1.O=C(O)C=CC=C1CCCCC1.O=C(O)C=CCC(F)(F)CC(F)(F)C(F)(F)F.O=C(O)C=CCCCc1ccco1.O=C(O)C=CCOc1ccccc1.O=C(O)C=CCc1c(F)c(F)c(F)c(F)c1F.O=C(O)C=CCc1ccccc1.O=C(O)C=Cc1ccccc1.O=C(O)CC=COC=CCC(=O)O.O=C1CC(C2CCCCC2)O1.O=C1CC(C=C2CCCCC2)O1.O=C1CC(CCC(F)(F)CC(F)(F)F)O1.O=C1CC(CCCc2ccco2)O1.O=C1CC(COCC2CC(=O)O2)O1.O=C1CC(COc2ccccc2)O1.O=C1CC(Cc2c(F)c(F)c(F)c(F)c2F)O1.O=C1CC(Cc2ccccc2)O1.O=C1CC(c2ccccc2)O1
InChIInChI=1S/2C11H12O3.2C10H5F5O2.2C10H16O4.C10H12O3.C10H10O3.C10H18O3.C10H12O3.C10H10O3.C10H18O3.C10H14O2.C10H10O2.C10H14O2.C10H10O2.2C9H14O4.C9H14O2.C9H8O2.2C9H14O2.C9H8O2.C9H14O2.C8H7F7O2.C8H9F5O2.2C8H10O5.C8H10O4.C8H12O4.C8H10O4.C8H12O4.2C8H14O2.2C7H10O3.2C4H6O2/c1-13-9-4-2-8(3-5-9)6-10-7-11(12)14-10;1-14-10-7-5-9(6-8-10)3-2-4-11(12)13;11-6-4(1-3-2-5(16)17-3)7(12)9(14)10(15)8(6)13;11-6-4(2-1-3-5(16)17)7(12)9(14)10(15)8(6)13;1-2-4-9(11)13-6-3-5-8-7-10(12)14-8;1-2-6-10(13)14-8-5-3-4-7-9(11)12;11-10-7-9(13-10)4-1-3-8-5-2-6-12-8;11-10-6-9(13-10)7-12-8-4-2-1-3-5-8;1-2-3-4-5-8(11)6-9-7-10(12)13-9;11-10(12)7-3-1-2-5-9-6-4-8-13-9;11-10(12)7-4-8-13-9-5-2-1-3-6-9;1-2-3-4-6-9(11)7-5-8-10(12)13;2*11-10-7-9(12-10)6-8-4-2-1-3-5-8;2*11-10(12)8-4-7-9-5-2-1-3-6-9;1-2-3-8(10)12-5-4-7-6-9(11)13-7;1-2-5-9(12)13-7-4-3-6-8(10)11;2*10-9-6-8(11-9)7-4-2-1-3-5-7;1-2-3-4-5-6-8-7-9(10)11-8;2*10-9(11)7-6-8-4-2-1-3-5-8;1-2-3-4-5-6-7-8-9(10)11;9-6(10,3-1-2-5(16)17)4-7(11,12)8(13,14)15;9-7(10,4-8(11,12)13)2-1-5-3-6(14)15-5;9-7-1-5(12-7)3-11-4-6-2-8(10)13-6;9-7(10)3-1-5-13-6-2-4-8(11)12;1-5(2)8(10)11-4-6-3-7(9)12-6;1-2-3-7(9)11-5-6-4-8(10)12-6;1-6(2)8(11)12-5-3-4-7(9)10;1-2-4-8(11)12-6-3-5-7(9)10;1-2-3-4-5-7-6-8(9)10-7;1-2-3-4-5-6-7-8(9)10;1-2-3-9-5-6-4-7(8)10-6;1-2-5-10-6-3-4-7(8)9;1-3-2-4(5)6-3;1-2-3-4(5)6/h2-5,10H,6-7H2,1H3;2,4-8H,3H2,1H3,(H,12,13);3H,1-2H2;1,3H,2H2,(H,16,17);8H,2-7H2,1H3;4,7H,2-3,5-6,8H2,1H3,(H,11,12);2,5-6,9H,1,3-4,7H2;1-5,9H,6-7H2;8-9,11H,2-7H2,1H3;3-4,6-8H,1-2,5H2,(H,11,12);1-7H,8H2,(H,11,12);5,8-9,11H,2-4,6-7H2,1H3,(H,12,13);6,9H,1-5,7H2;1-5,9H,6-7H2;4,7-8H,1-3,5-6H2,(H,11,12);1-6,8H,7H2,(H,11,12);7H,2-6H2,1H3;3,6H,2,4-5,7H2,1H3,(H,10,11);7-8H,1-6H2;1-5,8H,6H2;2,8H,1,3-7H2;6-8H,1-5H2,(H,10,11);1-7H,(H,10,11);2,7-8H,1,3-6H2,(H,10,11);1-2H,3-4H2,(H,16,17);5H,1-4H2;5-6H,1-4H2;1-2,5-6H,3-4H2,(H,9,10)(H,11,12);6H,1,3-4H2,2H3;6H,2-5H2,1H3;3-4H,1,5H2,2H3,(H,9,10);3,5H,2,4,6H2,1H3,(H,9,10);7H,2-6H2,1H3;6-7H,2-5H2,1H3,(H,9,10);2,6H,1,3-5H2;2-4H,1,5-6H2,(H,8,9);3H,2H2,1H3;2-3H,1H3,(H,5,6)/b;;;;;;;;;;;;;;;;;6-3+;;;;;;;;;;;;;;;;;;;;
InChIKeyIAAHELILPJDRNG-QBPGNXAPSA-N
MW6619.02 g/mol
LogP60.44
Rot. Bonds144

About 4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one

4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one (PubChem CID 158638107) has the molecular formula C336H434F22O108 and a molecular weight of 6619.02 g/mol. Its IUPAC name is 4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one.

Molecular Properties

Compound Name4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one
PubChem CID158638107
Molecular FormulaC336H434F22O108
Molecular Weight6619.02 g/mol
Exact Mass6614.81
IUPAC Name4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one
SMILESC=C(C)C(=O)OCC1CC(=O)O1.C=C(C)C(=O)OCC=CC(=O)O.C=CCCCCC1CC(=O)O1.C=CCCCCC=CC(=O)O.C=CCOCC1CC(=O)O1.C=CCOCC=CC(=O)O.CC1CC(=O)O1.CC=CC(=O)O.CCCC(=O)OCC/C=C/C(=O)O.CCCC(=O)OCC1CC(=O)O1.CCCC(=O)OCC=CC(=O)O.CCCC(=O)OCCC1CC(=O)O1.CCCC(=O)OCCCC1CC(=O)O1.CCCC(=O)OCCCC=CC(=O)O.CCCCCC(O)CC1CC(=O)O1.CCCCCC(O)CC=CC(=O)O.CCCCCC1CC(=O)O1.CCCCCC=CC(=O)O.COc1ccc(CC2CC(=O)O2)cc1.COc1ccc(CC=CC(=O)O)cc1.O=C(O)C=CC1CCCCC1.O=C(O)C=CC=C1CCCCC1.O=C(O)C=CCC(F)(F)CC(F)(F)C(F)(F)F.O=C(O)C=CCCCc1ccco1.O=C(O)C=CCOc1ccccc1.O=C(O)C=CCc1c(F)c(F)c(F)c(F)c1F.O=C(O)C=CCc1ccccc1.O=C(O)C=Cc1ccccc1.O=C(O)CC=COC=CCC(=O)O.O=C1CC(C2CCCCC2)O1.O=C1CC(C=C2CCCCC2)O1.O=C1CC(CCC(F)(F)CC(F)(F)F)O1.O=C1CC(CCCc2ccco2)O1.O=C1CC(COCC2CC(=O)O2)O1.O=C1CC(COc2ccccc2)O1.O=C1CC(Cc2c(F)c(F)c(F)c(F)c2F)O1.O=C1CC(Cc2ccccc2)O1.O=C1CC(c2ccccc2)O1
InChIInChI=1S/2C11H12O3.2C10H5F5O2.2C10H16O4.C10H12O3.C10H10O3.C10H18O3.C10H12O3.C10H10O3.C10H18O3.C10H14O2.C10H10O2.C10H14O2.C10H10O2.2C9H14O4.C9H14O2.C9H8O2.2C9H14O2.C9H8O2.C9H14O2.C8H7F7O2.C8H9F5O2.2C8H10O5.C8H10O4.C8H12O4.C8H10O4.C8H12O4.2C8H14O2.2C7H10O3.2C4H6O2/c1-13-9-4-2-8(3-5-9)6-10-7-11(12)14-10;1-14-10-7-5-9(6-8-10)3-2-4-11(12)13;11-6-4(1-3-2-5(16)17-3)7(12)9(14)10(15)8(6)13;11-6-4(2-1-3-5(16)17)7(12)9(14)10(15)8(6)13;1-2-4-9(11)13-6-3-5-8-7-10(12)14-8;1-2-6-10(13)14-8-5-3-4-7-9(11)12;11-10-7-9(13-10)4-1-3-8-5-2-6-12-8;11-10-6-9(13-10)7-12-8-4-2-1-3-5-8;1-2-3-4-5-8(11)6-9-7-10(12)13-9;11-10(12)7-3-1-2-5-9-6-4-8-13-9;11-10(12)7-4-8-13-9-5-2-1-3-6-9;1-2-3-4-6-9(11)7-5-8-10(12)13;2*11-10-7-9(12-10)6-8-4-2-1-3-5-8;2*11-10(12)8-4-7-9-5-2-1-3-6-9;1-2-3-8(10)12-5-4-7-6-9(11)13-7;1-2-5-9(12)13-7-4-3-6-8(10)11;2*10-9-6-8(11-9)7-4-2-1-3-5-7;1-2-3-4-5-6-8-7-9(10)11-8;2*10-9(11)7-6-8-4-2-1-3-5-8;1-2-3-4-5-6-7-8-9(10)11;9-6(10,3-1-2-5(16)17)4-7(11,12)8(13,14)15;9-7(10,4-8(11,12)13)2-1-5-3-6(14)15-5;9-7-1-5(12-7)3-11-4-6-2-8(10)13-6;9-7(10)3-1-5-13-6-2-4-8(11)12;1-5(2)8(10)11-4-6-3-7(9)12-6;1-2-3-7(9)11-5-6-4-8(10)12-6;1-6(2)8(11)12-5-3-4-7(9)10;1-2-4-8(11)12-6-3-5-7(9)10;1-2-3-4-5-7-6-8(9)10-7;1-2-3-4-5-6-7-8(9)10;1-2-3-9-5-6-4-7(8)10-6;1-2-5-10-6-3-4-7(8)9;1-3-2-4(5)6-3;1-2-3-4(5)6/h2-5,10H,6-7H2,1H3;2,4-8H,3H2,1H3,(H,12,13);3H,1-2H2;1,3H,2H2,(H,16,17);8H,2-7H2,1H3;4,7H,2-3,5-6,8H2,1H3,(H,11,12);2,5-6,9H,1,3-4,7H2;1-5,9H,6-7H2;8-9,11H,2-7H2,1H3;3-4,6-8H,1-2,5H2,(H,11,12);1-7H,8H2,(H,11,12);5,8-9,11H,2-4,6-7H2,1H3,(H,12,13);6,9H,1-5,7H2;1-5,9H,6-7H2;4,7-8H,1-3,5-6H2,(H,11,12);1-6,8H,7H2,(H,11,12);7H,2-6H2,1H3;3,6H,2,4-5,7H2,1H3,(H,10,11);7-8H,1-6H2;1-5,8H,6H2;2,8H,1,3-7H2;6-8H,1-5H2,(H,10,11);1-7H,(H,10,11);2,7-8H,1,3-6H2,(H,10,11);1-2H,3-4H2,(H,16,17);5H,1-4H2;5-6H,1-4H2;1-2,5-6H,3-4H2,(H,9,10)(H,11,12);6H,1,3-4H2,2H3;6H,2-5H2,1H3;3-4H,1,5H2,2H3,(H,9,10);3,5H,2,4,6H2,1H3,(H,9,10);7H,2-6H2,1H3;6-7H,2-5H2,1H3,(H,9,10);2,6H,1,3-5H2;2-4H,1,5-6H2,(H,8,9);3H,2H2,1H3;2-3H,1H3,(H,5,6)/b;;;;;;;;;;;;;;;;;6-3+;;;;;;;;;;;;;;;;;;;;
InChIKeyIAAHELILPJDRNG-QBPGNXAPSA-N
XLogP60.44
TPSA1622.98 Ų
H-Bond Donors22
H-Bond Acceptors88
Rotatable Bonds144
Heavy Atoms466
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5006619.02
LogP ≤ 560.44
H-Bond Donors ≤ 522
H-Bond Acceptors ≤ 1088

Analyze 4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one?
The IUPAC name of 4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one (CID 158638107) is 4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one.
What is the SMILES notation for 4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one?
The canonical SMILES for 4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one is C=C(C)C(=O)OCC1CC(=O)O1.C=C(C)C(=O)OCC=CC(=O)O.C=CCCCCC1CC(=O)O1.C=CCCCCC=CC(=O)O.C=CCOCC1CC(=O)O1.C=CCOCC=CC(=O)O.CC1CC(=O)O1.CC=CC(=O)O.CCCC(=O)OCC/C=C/C(=O)O.CCCC(=O)OCC1CC(=O)O1.CCCC(=O)OCC=CC(=O)O.CCCC(=O)OCCC1CC(=O)O1.CCCC(=O)OCCCC1CC(=O)O1.CCCC(=O)OCCCC=CC(=O)O.CCCCCC(O)CC1CC(=O)O1.CCCCCC(O)CC=CC(=O)O.CCCCCC1CC(=O)O1.CCCCCC=CC(=O)O.COc1ccc(CC2CC(=O)O2)cc1.COc1ccc(CC=CC(=O)O)cc1.O=C(O)C=CC1CCCCC1.O=C(O)C=CC=C1CCCCC1.O=C(O)C=CCC(F)(F)CC(F)(F)C(F)(F)F.O=C(O)C=CCCCc1ccco1.O=C(O)C=CCOc1ccccc1.O=C(O)C=CCc1c(F)c(F)c(F)c(F)c1F.O=C(O)C=CCc1ccccc1.O=C(O)C=Cc1ccccc1.O=C(O)CC=COC=CCC(=O)O.O=C1CC(C2CCCCC2)O1.O=C1CC(C=C2CCCCC2)O1.O=C1CC(CCC(F)(F)CC(F)(F)F)O1.O=C1CC(CCCc2ccco2)O1.O=C1CC(COCC2CC(=O)O2)O1.O=C1CC(COc2ccccc2)O1.O=C1CC(Cc2c(F)c(F)c(F)c(F)c2F)O1.O=C1CC(Cc2ccccc2)O1.O=C1CC(c2ccccc2)O1.
What is the InChIKey of 4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one?
The InChIKey is IAAHELILPJDRNG-QBPGNXAPSA-N. The full InChI is InChI=1S/2C11H12O3.2C10H5F5O2.2C10H16O4.C10H12O3.C10H10O3.C10H18O3.C10H12O3.C10H10O3.C10H18O3.C10H14O2.C10H10O2.C10H14O2.C10H10O2.2C9H14O4.C9H14O2.C9H8O2.2C9H14O2.C9H8O2.C9H14O2.C8H7F7O2.C8H9F5O2.2C8H10O5.C8H10O4.C8H12O4.C8H10O4.C8H12O4.2C8H14O2.2C7H10O3.2C4H6O2/c1-13-9-4-2-8(3-5-9)6-10-7-11(12)14-10;1-14-10-7-5-9(6-8-10)3-2-4-11(12)13;11-6-4(1-3-2-5(16)17-3)7(12)9(14)10(15)8(6)13;11-6-4(2-1-3-5(16)17)7(12)9(14)10(15)8(6)13;1-2-4-9(11)13-6-3-5-8-7-10(12)14-8;1-2-6-10(13)14-8-5-3-4-7-9(11)12;11-10-7-9(13-10)4-1-3-8-5-2-6-12-8;11-10-6-9(13-10)7-12-8-4-2-1-3-5-8;1-2-3-4-5-8(11)6-9-7-10(12)13-9;11-10(12)7-3-1-2-5-9-6-4-8-13-9;11-10(12)7-4-8-13-9-5-2-1-3-6-9;1-2-3-4-6-9(11)7-5-8-10(12)13;2*11-10-7-9(12-10)6-8-4-2-1-3-5-8;2*11-10(12)8-4-7-9-5-2-1-3-6-9;1-2-3-8(10)12-5-4-7-6-9(11)13-7;1-2-5-9(12)13-7-4-3-6-8(10)11;2*10-9-6-8(11-9)7-4-2-1-3-5-7;1-2-3-4-5-6-8-7-9(10)11-8;2*10-9(11)7-6-8-4-2-1-3-5-8;1-2-3-4-5-6-7-8-9(10)11;9-6(10,3-1-2-5(16)17)4-7(11,12)8(13,14)15;9-7(10,4-8(11,12)13)2-1-5-3-6(14)15-5;9-7-1-5(12-7)3-11-4-6-2-8(10)13-6;9-7(10)3-1-5-13-6-2-4-8(11)12;1-5(2)8(10)11-4-6-3-7(9)12-6;1-2-3-7(9)11-5-6-4-8(10)12-6;1-6(2)8(11)12-5-3-4-7(9)10;1-2-4-8(11)12-6-3-5-7(9)10;1-2-3-4-5-7-6-8(9)10-7;1-2-3-4-5-6-7-8(9)10;1-2-3-9-5-6-4-7(8)10-6;1-2-5-10-6-3-4-7(8)9;1-3-2-4(5)6-3;1-2-3-4(5)6/h2-5,10H,6-7H2,1H3;2,4-8H,3H2,1H3,(H,12,13);3H,1-2H2;1,3H,2H2,(H,16,17);8H,2-7H2,1H3;4,7H,2-3,5-6,8H2,1H3,(H,11,12);2,5-6,9H,1,3-4,7H2;1-5,9H,6-7H2;8-9,11H,2-7H2,1H3;3-4,6-8H,1-2,5H2,(H,11,12);1-7H,8H2,(H,11,12);5,8-9,11H,2-4,6-7H2,1H3,(H,12,13);6,9H,1-5,7H2;1-5,9H,6-7H2;4,7-8H,1-3,5-6H2,(H,11,12);1-6,8H,7H2,(H,11,12);7H,2-6H2,1H3;3,6H,2,4-5,7H2,1H3,(H,10,11);7-8H,1-6H2;1-5,8H,6H2;2,8H,1,3-7H2;6-8H,1-5H2,(H,10,11);1-7H,(H,10,11);2,7-8H,1,3-6H2,(H,10,11);1-2H,3-4H2,(H,16,17);5H,1-4H2;5-6H,1-4H2;1-2,5-6H,3-4H2,(H,9,10)(H,11,12);6H,1,3-4H2,2H3;6H,2-5H2,1H3;3-4H,1,5H2,2H3,(H,9,10);3,5H,2,4,6H2,1H3,(H,9,10);7H,2-6H2,1H3;6-7H,2-5H2,1H3,(H,9,10);2,6H,1,3-5H2;2-4H,1,5-6H2,(H,8,9);3H,2H2,1H3;2-3H,1H3,(H,5,6)/b;;;;;;;;;;;;;;;;;6-3+;;;;;;;;;;;;;;;;;;;;.
What are the key properties of 4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one?
4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one has a molecular weight of 6619.02 g/mol, XLogP of 60.44, 144 rotatable bonds, 22 hydrogen bond donors, and 88 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyloxetan-2-one;4-butanoyloxybut-2-enoic acid;6-butanoyloxyhex-2-enoic acid;(E)-5-butanoyloxypent-2-enoic acid;but-2-enoic acid;4-(3-carboxyprop-1-enoxy)but-3-enoic acid;4-cyclohexylidenebut-2-enoic acid;4-(cyclohexylidenemethyl)oxetan-2-one;4-cyclohexyloxetan-2-one;3-cyclohexylprop-2-enoic acid;6-(furan-2-yl)hex-2-enoic acid;4-[3-(furan-2-yl)propyl]oxetan-2-one;5,5,7,7,8,8,8-heptafluorooct-2-enoic acid;4-hex-5-enyloxetan-2-one;5-hydroxydec-2-enoic acid;4-(2-hydroxyheptyl)oxetan-2-one;4-(4-methoxyphenyl)but-2-enoic acid;4-[(4-methoxyphenyl)methyl]oxetan-2-one;4-methyloxetan-2-one;4-(2-methylprop-2-enoyloxy)but-2-enoic acid;nona-2,8-dienoic acid;oct-2-enoic acid;2-(4-oxooxetan-2-yl)ethyl butanoate;4-[(4-oxooxetan-2-yl)methoxymethyl]oxetan-2-one;(4-oxooxetan-2-yl)methyl butanoate;(4-oxooxetan-2-yl)methyl 2-methylprop-2-enoate;3-(4-oxooxetan-2-yl)propyl butanoate;4-(3,3,5,5,5-pentafluoropentyl)oxetan-2-one;4-(2,3,4,5,6-pentafluorophenyl)but-2-enoic acid;4-[(2,3,4,5,6-pentafluorophenyl)methyl]oxetan-2-one;4-pentyloxetan-2-one;4-phenoxybut-2-enoic acid;4-(phenoxymethyl)oxetan-2-one;4-phenylbut-2-enoic acid;4-phenyloxetan-2-one;3-phenylprop-2-enoic acid;4-prop-2-enoxybut-2-enoic acid;4-(prop-2-enoxymethyl)oxetan-2-one is sourced from PubChem (CID 158638107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).