[3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium)

C215H235F39O44S12 — CID 157255580

IUPAC[3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium)
SMILESC=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC(C)(C1CCC(C(C)(O)C(F)(F)F)CC1)C(F)(F)F.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC(C1CCCCC1)C(C)(O)C(F)(F)F.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC(CC(C)C)C(C)(O)C(F)(F)F.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC1CC(C(C)(O)C(F)(F)F)CC(C(O)(C(F)(F)F)C(F)(F)F)C1.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC1CCC(C(C)(O)C(F)(F)F)CC1.CC(=O)OC(C)(CC1CC2CCC1C2)C(F)(F)F.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/6C19H17S.C18H21F11O8S.C18H24F8O7S.C16H23F5O7S.C15H21F5O7S.C14H21F5O7S.C13H19F3O2.C7H10F2O6S/c6*1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18;1-8(6-36-7-14(19,20)38(33,34)35)12(30)37-11-4-9(13(2,31)16(21,22)23)3-10(5-11)15(32,17(24,25)26)18(27,28)29;1-10(8-32-9-16(19,20)34(29,30)31)13(27)33-15(3,18(24,25)26)12-6-4-11(5-7-12)14(2,28)17(21,22)23;1-10(8-27-9-15(17,18)29(24,25)26)13(22)28-12(11-6-4-3-5-7-11)14(2,23)16(19,20)21;1-9(7-26-8-14(16,17)28(23,24)25)12(21)27-11-5-3-10(4-6-11)13(2,22)15(18,19)20;1-8(2)5-10(12(4,21)14(17,18)19)26-11(20)9(3)6-25-7-13(15,16)27(22,23)24;1-8(17)18-12(2,13(14,15)16)7-11-6-9-3-4-10(11)5-9;1-5(6(10)14-2)3-15-4-7(8,9)16(11,12)13/h6*2-15H,1H3;9-11,31-32H,1,3-7H2,2H3,(H,33,34,35);11-12,28H,1,4-9H2,2-3H3,(H,29,30,31);11-12,23H,1,3-9H2,2H3,(H,24,25,26);10-11,22H,1,3-8H2,2H3,(H,23,24,25);8,10,21H,3,5-7H2,1-2,4H3,(H,22,23,24);9-11H,3-7H2,1-2H3;1,3-4H2,2H3,(H,11,12,13)/q6*+1;;;;;;;/p-6
InChIKeyAWVVPVCEOGLPME-UHFFFAOYSA-H
MW4648.93 g/mol
LogP47.57
Rot. Bonds72

About [3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium)

[3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium) (PubChem CID 157255580) has the molecular formula C215H235F39O44S12 and a molecular weight of 4648.93 g/mol. Its IUPAC name is [3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium).

Molecular Properties

Compound Name[3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium)
PubChem CID157255580
Molecular FormulaC215H235F39O44S12
Molecular Weight4648.93 g/mol
Exact Mass4645.22
IUPAC Name[3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium)
SMILESC=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC(C)(C1CCC(C(C)(O)C(F)(F)F)CC1)C(F)(F)F.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC(C1CCCCC1)C(C)(O)C(F)(F)F.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC(CC(C)C)C(C)(O)C(F)(F)F.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC1CC(C(C)(O)C(F)(F)F)CC(C(O)(C(F)(F)F)C(F)(F)F)C1.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC1CCC(C(C)(O)C(F)(F)F)CC1.CC(=O)OC(C)(CC1CC2CCC1C2)C(F)(F)F.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/6C19H17S.C18H21F11O8S.C18H24F8O7S.C16H23F5O7S.C15H21F5O7S.C14H21F5O7S.C13H19F3O2.C7H10F2O6S/c6*1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18;1-8(6-36-7-14(19,20)38(33,34)35)12(30)37-11-4-9(13(2,31)16(21,22)23)3-10(5-11)15(32,17(24,25)26)18(27,28)29;1-10(8-32-9-16(19,20)34(29,30)31)13(27)33-15(3,18(24,25)26)12-6-4-11(5-7-12)14(2,28)17(21,22)23;1-10(8-27-9-15(17,18)29(24,25)26)13(22)28-12(11-6-4-3-5-7-11)14(2,23)16(19,20)21;1-9(7-26-8-14(16,17)28(23,24)25)12(21)27-11-5-3-10(4-6-11)13(2,22)15(18,19)20;1-8(2)5-10(12(4,21)14(17,18)19)26-11(20)9(3)6-25-7-13(15,16)27(22,23)24;1-8(17)18-12(2,13(14,15)16)7-11-6-9-3-4-10(11)5-9;1-5(6(10)14-2)3-15-4-7(8,9)16(11,12)13/h6*2-15H,1H3;9-11,31-32H,1,3-7H2,2H3,(H,33,34,35);11-12,28H,1,4-9H2,2-3H3,(H,29,30,31);11-12,23H,1,3-9H2,2H3,(H,24,25,26);10-11,22H,1,3-8H2,2H3,(H,23,24,25);8,10,21H,3,5-7H2,1-2,4H3,(H,22,23,24);9-11H,3-7H2,1-2H3;1,3-4H2,2H3,(H,11,12,13)/q6*+1;;;;;;;/p-6
InChIKeyAWVVPVCEOGLPME-UHFFFAOYSA-H
XLogP47.57
TPSA704.06 Ų
H-Bond Donors6
H-Bond Acceptors44
Rotatable Bonds72
Heavy Atoms310
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004648.93
LogP ≤ 547.57
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1044

Analyze [3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium) with MolForge

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Frequently Asked Questions

What is the IUPAC name of [3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium)?
The IUPAC name of [3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium) (CID 157255580) is [3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium).
What is the SMILES notation for [3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium)?
The canonical SMILES for [3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium) is C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC(C)(C1CCC(C(C)(O)C(F)(F)F)CC1)C(F)(F)F.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC(C1CCCCC1)C(C)(O)C(F)(F)F.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC(CC(C)C)C(C)(O)C(F)(F)F.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC1CC(C(C)(O)C(F)(F)F)CC(C(O)(C(F)(F)F)C(F)(F)F)C1.C=C(COCC(F)(F)S(=O)(=O)[O-])C(=O)OC1CCC(C(C)(O)C(F)(F)F)CC1.CC(=O)OC(C)(CC1CC2CCC1C2)C(F)(F)F.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of [3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium)?
The InChIKey is AWVVPVCEOGLPME-UHFFFAOYSA-H. The full InChI is InChI=1S/6C19H17S.C18H21F11O8S.C18H24F8O7S.C16H23F5O7S.C15H21F5O7S.C14H21F5O7S.C13H19F3O2.C7H10F2O6S/c6*1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18;1-8(6-36-7-14(19,20)38(33,34)35)12(30)37-11-4-9(13(2,31)16(21,22)23)3-10(5-11)15(32,17(24,25)26)18(27,28)29;1-10(8-32-9-16(19,20)34(29,30)31)13(27)33-15(3,18(24,25)26)12-6-4-11(5-7-12)14(2,28)17(21,22)23;1-10(8-27-9-15(17,18)29(24,25)26)13(22)28-12(11-6-4-3-5-7-11)14(2,23)16(19,20)21;1-9(7-26-8-14(16,17)28(23,24)25)12(21)27-11-5-3-10(4-6-11)13(2,22)15(18,19)20;1-8(2)5-10(12(4,21)14(17,18)19)26-11(20)9(3)6-25-7-13(15,16)27(22,23)24;1-8(17)18-12(2,13(14,15)16)7-11-6-9-3-4-10(11)5-9;1-5(6(10)14-2)3-15-4-7(8,9)16(11,12)13/h6*2-15H,1H3;9-11,31-32H,1,3-7H2,2H3,(H,33,34,35);11-12,28H,1,4-9H2,2-3H3,(H,29,30,31);11-12,23H,1,3-9H2,2H3,(H,24,25,26);10-11,22H,1,3-8H2,2H3,(H,23,24,25);8,10,21H,3,5-7H2,1-2,4H3,(H,22,23,24);9-11H,3-7H2,1-2H3;1,3-4H2,2H3,(H,11,12,13)/q6*+1;;;;;;;/p-6.
What are the key properties of [3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium)?
[3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium) has a molecular weight of 4648.93 g/mol, XLogP of 47.57, 72 rotatable bonds, 6 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-bicyclo[2.2.1]heptanyl)-1,1,1-trifluoro-2-methylpropan-2-yl] acetate;2-[2-(1-cyclohexyl-3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)carbonylprop-2-enoxy]-1,1-difluoroethanesulfonate;1,1-difluoro-2-[2-[3-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-(2-methoxycarbonylprop-2-enoxy)ethanesulfonate;1,1-difluoro-2-[2-(1,1,1-trifluoro-2-hydroxy-2,5-dimethylhexan-3-yl)oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]oxycarbonylprop-2-enoxy]ethanesulfonate;1,1-difluoro-2-[2-[1,1,1-trifluoro-2-[4-(1,1,1-trifluoro-2-hydroxypropan-2-yl)cyclohexyl]propan-2-yl]oxycarbonylprop-2-enoxy]ethanesulfonate;hexakis((4-methylphenyl)-diphenylsulfanium) is sourced from PubChem (CID 157255580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).