bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate

C160H191F57O54 — CID 157281326

IUPACbis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC(C)(C1CCC(C(C)(C)C(F)(F)F)CC1)C(F)(F)F.C=C(C)C(=O)OC(C)CC(C)(O)C(F)(F)F.C=C(C)C(=O)OC(CC)CC(C)(O)C(F)(F)F.C=C(C)C(=O)OC1(C)C(F)(F)OC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OC1(C)COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OC1C(F)(F)OC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OC1COC(O)(C(F)(F)F)C1.C=C(C)C(=O)OC1COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCC1(C)COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCC1(C)COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCC1COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCCC(C)(O)C(F)(F)F.C=C(C)C(=O)OCCCC(C)(C)O.C=C(C)C(=O)Oc1ccc2c(c1)OC(=O)C2.C=C(C)C(=O)Oc1cccc2c1OC(=O)C2
InChIInChI=1S/C17H24F6O2.2C12H10O4.2C11H13F5O4.C11H17F3O3.C10H9F7O4.2C10H11F5O4.C10H15F3O3.C10H18O3.C9H7F7O4.C9H9F5O4.C9H11F3O4.C9H13F3O3/c1-10(2)13(24)25-15(5,17(21,22)23)12-8-6-11(7-9-12)14(3,4)16(18,19)20;1-7(2)12(14)15-9-4-3-8-5-11(13)16-10(8)6-9;1-7(2)12(14)15-9-5-3-4-8-6-10(13)16-11(8)9;2*1-6(2)7(17)19-4-8(3)5-20-10(18,9(8,12)13)11(14,15)16;1-5-8(17-9(15)7(2)3)6-10(4,16)11(12,13)14;1-4(2)5(18)20-6(3)7(11,12)8(19,9(13,14)15)21-10(6,16)17;1-5(2)6(16)19-7(3)4-18-9(17,8(7,11)12)10(13,14)15;1-5(2)7(16)18-3-6-4-19-9(17,8(6,11)12)10(13,14)15;1-6(2)8(14)16-7(3)5-9(4,15)10(11,12)13;1-8(2)9(11)13-7-5-6-10(3,4)12;1-3(2)4(17)19-5-6(10,11)8(18,9(14,15)16)20-7(5,12)13;1-4(2)6(15)18-5-3-17-8(16,7(5,10)11)9(12,13)14;1-5(2)7(13)16-6-3-8(14,15-4-6)9(10,11)12;1-6(2)7(13)15-5-4-8(3,14)9(10,11)12/h11-12H,1,6-9H2,2-5H3;3-4,6H,1,5H2,2H3;3-5H,1,6H2,2H3;2*18H,1,4-5H2,2-3H3;8,16H,2,5-6H2,1,3-4H3;19H,1H2,2-3H3;17H,1,4H2,2-3H3;6,17H,1,3-4H2,2H3;7,15H,1,5H2,2-4H3;12H,1,5-7H2,2-4H3;5,18H,1H2,2H3;5,16H,1,3H2,2H3;6,14H,1,3-4H2,2H3;14H,1,4-5H2,2-3H3
InChIKeyAZRVJQNKPGJUPV-UHFFFAOYSA-N
MW4061.12 g/mol
LogP31.70
Rot. Bonds45

About bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate

bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate (PubChem CID 157281326) has the molecular formula C160H191F57O54 and a molecular weight of 4061.12 g/mol. Its IUPAC name is bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate.

Molecular Properties

Compound Namebis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate
PubChem CID157281326
Molecular FormulaC160H191F57O54
Molecular Weight4061.12 g/mol
Exact Mass4059.13
IUPAC Namebis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate
SMILESC=C(C)C(=O)OC(C)(C1CCC(C(C)(C)C(F)(F)F)CC1)C(F)(F)F.C=C(C)C(=O)OC(C)CC(C)(O)C(F)(F)F.C=C(C)C(=O)OC(CC)CC(C)(O)C(F)(F)F.C=C(C)C(=O)OC1(C)C(F)(F)OC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OC1(C)COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OC1C(F)(F)OC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OC1COC(O)(C(F)(F)F)C1.C=C(C)C(=O)OC1COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCC1(C)COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCC1(C)COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCC1COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCCC(C)(O)C(F)(F)F.C=C(C)C(=O)OCCCC(C)(C)O.C=C(C)C(=O)Oc1ccc2c(c1)OC(=O)C2.C=C(C)C(=O)Oc1cccc2c1OC(=O)C2
InChIInChI=1S/C17H24F6O2.2C12H10O4.2C11H13F5O4.C11H17F3O3.C10H9F7O4.2C10H11F5O4.C10H15F3O3.C10H18O3.C9H7F7O4.C9H9F5O4.C9H11F3O4.C9H13F3O3/c1-10(2)13(24)25-15(5,17(21,22)23)12-8-6-11(7-9-12)14(3,4)16(18,19)20;1-7(2)12(14)15-9-4-3-8-5-11(13)16-10(8)6-9;1-7(2)12(14)15-9-5-3-4-8-6-10(13)16-11(8)9;2*1-6(2)7(17)19-4-8(3)5-20-10(18,9(8,12)13)11(14,15)16;1-5-8(17-9(15)7(2)3)6-10(4,16)11(12,13)14;1-4(2)5(18)20-6(3)7(11,12)8(19,9(13,14)15)21-10(6,16)17;1-5(2)6(16)19-7(3)4-18-9(17,8(7,11)12)10(13,14)15;1-5(2)7(16)18-3-6-4-19-9(17,8(6,11)12)10(13,14)15;1-6(2)8(14)16-7(3)5-9(4,15)10(11,12)13;1-8(2)9(11)13-7-5-6-10(3,4)12;1-3(2)4(17)19-5-6(10,11)8(18,9(14,15)16)20-7(5,12)13;1-4(2)6(15)18-5-3-17-8(16,7(5,10)11)9(12,13)14;1-5(2)7(13)16-6-3-8(14,15-4-6)9(10,11)12;1-6(2)7(13)15-5-4-8(3,14)9(10,11)12/h11-12H,1,6-9H2,2-5H3;3-4,6H,1,5H2,2H3;3-5H,1,6H2,2H3;2*18H,1,4-5H2,2-3H3;8,16H,2,5-6H2,1,3-4H3;19H,1H2,2-3H3;17H,1,4H2,2-3H3;6,17H,1,3-4H2,2H3;7,15H,1,5H2,2-4H3;12H,1,5-7H2,2-4H3;5,18H,1H2,2H3;5,16H,1,3H2,2H3;6,14H,1,3-4H2,2H3;14H,1,4-5H2,2-3H3
InChIKeyAZRVJQNKPGJUPV-UHFFFAOYSA-N
XLogP31.70
TPSA763.70 Ų
H-Bond Donors12
H-Bond Acceptors54
Rotatable Bonds45
Heavy Atoms271
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004061.12
LogP ≤ 531.70
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1054

Analyze bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate with MolForge

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Frequently Asked Questions

What is the IUPAC name of bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate?
The IUPAC name of bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate (CID 157281326) is bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate.
What is the SMILES notation for bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate?
The canonical SMILES for bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate is C=C(C)C(=O)OC(C)(C1CCC(C(C)(C)C(F)(F)F)CC1)C(F)(F)F.C=C(C)C(=O)OC(C)CC(C)(O)C(F)(F)F.C=C(C)C(=O)OC(CC)CC(C)(O)C(F)(F)F.C=C(C)C(=O)OC1(C)C(F)(F)OC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OC1(C)COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OC1C(F)(F)OC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OC1COC(O)(C(F)(F)F)C1.C=C(C)C(=O)OC1COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCC1(C)COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCC1(C)COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCC1COC(O)(C(F)(F)F)C1(F)F.C=C(C)C(=O)OCCC(C)(O)C(F)(F)F.C=C(C)C(=O)OCCCC(C)(C)O.C=C(C)C(=O)Oc1ccc2c(c1)OC(=O)C2.C=C(C)C(=O)Oc1cccc2c1OC(=O)C2.
What is the InChIKey of bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate?
The InChIKey is AZRVJQNKPGJUPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24F6O2.2C12H10O4.2C11H13F5O4.C11H17F3O3.C10H9F7O4.2C10H11F5O4.C10H15F3O3.C10H18O3.C9H7F7O4.C9H9F5O4.C9H11F3O4.C9H13F3O3/c1-10(2)13(24)25-15(5,17(21,22)23)12-8-6-11(7-9-12)14(3,4)16(18,19)20;1-7(2)12(14)15-9-4-3-8-5-11(13)16-10(8)6-9;1-7(2)12(14)15-9-5-3-4-8-6-10(13)16-11(8)9;2*1-6(2)7(17)19-4-8(3)5-20-10(18,9(8,12)13)11(14,15)16;1-5-8(17-9(15)7(2)3)6-10(4,16)11(12,13)14;1-4(2)5(18)20-6(3)7(11,12)8(19,9(13,14)15)21-10(6,16)17;1-5(2)6(16)19-7(3)4-18-9(17,8(7,11)12)10(13,14)15;1-5(2)7(16)18-3-6-4-19-9(17,8(6,11)12)10(13,14)15;1-6(2)8(14)16-7(3)5-9(4,15)10(11,12)13;1-8(2)9(11)13-7-5-6-10(3,4)12;1-3(2)4(17)19-5-6(10,11)8(18,9(14,15)16)20-7(5,12)13;1-4(2)6(15)18-5-3-17-8(16,7(5,10)11)9(12,13)14;1-5(2)7(13)16-6-3-8(14,15-4-6)9(10,11)12;1-6(2)7(13)15-5-4-8(3,14)9(10,11)12/h11-12H,1,6-9H2,2-5H3;3-4,6H,1,5H2,2H3;3-5H,1,6H2,2H3;2*18H,1,4-5H2,2-3H3;8,16H,2,5-6H2,1,3-4H3;19H,1H2,2-3H3;17H,1,4H2,2-3H3;6,17H,1,3-4H2,2H3;7,15H,1,5H2,2-4H3;12H,1,5-7H2,2-4H3;5,18H,1H2,2H3;5,16H,1,3H2,2H3;6,14H,1,3-4H2,2H3;14H,1,4-5H2,2-3H3.
What are the key properties of bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate?
bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate has a molecular weight of 4061.12 g/mol, XLogP of 31.70, 45 rotatable bonds, 12 hydrogen bond donors, and 54 hydrogen bond acceptors.
Where does this data come from?
All data for bis([4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate);[4,4-difluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl]methyl 2-methylprop-2-enoate;[4,4-difluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4-hydroxy-4-methylpentyl) 2-methylprop-2-enoate;[5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-6-yl) 2-methylprop-2-enoate;(2-oxo-3H-1-benzofuran-7-yl) 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-3-methyl-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;[2,2,4,4-tetrafluoro-5-hydroxy-5-(trifluoromethyl)oxolan-3-yl] 2-methylprop-2-enoate;(4,4,4-trifluoro-3-hydroxy-3-methylbutyl) 2-methylprop-2-enoate;(6,6,6-trifluoro-5-hydroxy-5-methylhexan-3-yl) 2-methylprop-2-enoate;(5,5,5-trifluoro-4-hydroxy-4-methylpentan-2-yl) 2-methylprop-2-enoate;[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-methylpropan-2-yl)cyclohexyl]propan-2-yl] 2-methylprop-2-enoate is sourced from PubChem (CID 157281326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).