2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium

C266H281F39IN2O32S18+ — CID 159814757

IUPAC2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium
SMILESCCC(C)(C)c1ccc([IH+])cc1.Cc1c(F)c(F)c(F)c(F)c1F.Fc1ccc([S+](c2ccc(F)cc2)c2ccc(F)cc2)cc1.O=C(OCC(F)(F)S(=O)(=O)[O-])C12CC3CC(CC(C3)C1)C2.O=S(=O)([N-]S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)Oc1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1)C(F)(F)F.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)Oc1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1.O=S(=O)([O-])C(F)(F)C(F)(F)C1CC2CCC1C2.O=S(=O)([O-])c1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1.O=S(=O)([O-])c1c(F)c(F)c(Oc2c(C3CCCCC3)cc(C3CCCCC3)cc2C2CCCCC2)c(F)c1F.O=S1(=O)[N-]S(=O)(=O)C(F)(F)C(F)(F)C1(F)F.[SH2+]c1ccccc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C30H36F4O4S.C28H35F9NO7S3.C27H36F6O6S2.C24H36O3S.C18H12F3S.5C18H15S.C13H18F2O5S.C11H16I.C9H12F4O3S.C7H3F5.C6H6S.C3F6NO4S2/c31-24-26(33)30(39(35,36)37)27(34)25(32)29(24)38-28-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(28)20-14-8-3-9-15-20;29-25(30,26(31,32)46(39,40)38-47(41,42)28(35,36)37)27(33,34)48(43,44)45-24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20;28-25(29,26(30,31)40(34,35)36)27(32,33)41(37,38)39-24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20;25-28(26,27)24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20;19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18;5*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;14-13(15,21(17,18)19)7-20-11(16)12-4-8-1-9(5-12)3-10(2-8)6-12;1-4-11(2,3)9-5-7-10(12)8-6-9;10-8(11,9(12,13)17(14,15)16)7-4-5-1-2-6(7)3-5;1-2-3(8)5(10)7(12)6(11)4(2)9;7-6-4-2-1-3-5-6;4-1(5)2(6,7)15(11,12)10-16(13,14)3(1,8)9/h16-20H,1-15H2,(H,35,36,37);16-20H,1-15H2;16-20H,1-15H2,(H,34,35,36);16-20H,1-15H2,(H,25,26,27);1-12H;5*1-15H;8-10H,1-7H2,(H,17,18,19);5-8,12H,4H2,1-3H3;5-7H,1-4H2,(H,14,15,16);1H3;1-5,7H;/q;-1;;;6*+1;;+1;;;;-1/p-4
InChIKeyNLLYKZQXMPKBBZ-UHFFFAOYSA-J
MW5463.19 g/mol
LogP70.25
Rot. Bonds57

About 2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium

2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium (PubChem CID 159814757) has the molecular formula C266H281F39IN2O32S18+ and a molecular weight of 5463.19 g/mol. Its IUPAC name is 2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium.

Molecular Properties

Compound Name2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium
PubChem CID159814757
Molecular FormulaC266H281F39IN2O32S18+
Molecular Weight5463.19 g/mol
Exact Mass5458.38
IUPAC Name2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium
SMILESCCC(C)(C)c1ccc([IH+])cc1.Cc1c(F)c(F)c(F)c(F)c1F.Fc1ccc([S+](c2ccc(F)cc2)c2ccc(F)cc2)cc1.O=C(OCC(F)(F)S(=O)(=O)[O-])C12CC3CC(CC(C3)C1)C2.O=S(=O)([N-]S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)Oc1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1)C(F)(F)F.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)Oc1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1.O=S(=O)([O-])C(F)(F)C(F)(F)C1CC2CCC1C2.O=S(=O)([O-])c1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1.O=S(=O)([O-])c1c(F)c(F)c(Oc2c(C3CCCCC3)cc(C3CCCCC3)cc2C2CCCCC2)c(F)c1F.O=S1(=O)[N-]S(=O)(=O)C(F)(F)C(F)(F)C1(F)F.[SH2+]c1ccccc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C30H36F4O4S.C28H35F9NO7S3.C27H36F6O6S2.C24H36O3S.C18H12F3S.5C18H15S.C13H18F2O5S.C11H16I.C9H12F4O3S.C7H3F5.C6H6S.C3F6NO4S2/c31-24-26(33)30(39(35,36)37)27(34)25(32)29(24)38-28-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(28)20-14-8-3-9-15-20;29-25(30,26(31,32)46(39,40)38-47(41,42)28(35,36)37)27(33,34)48(43,44)45-24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20;28-25(29,26(30,31)40(34,35)36)27(32,33)41(37,38)39-24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20;25-28(26,27)24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20;19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18;5*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;14-13(15,21(17,18)19)7-20-11(16)12-4-8-1-9(5-12)3-10(2-8)6-12;1-4-11(2,3)9-5-7-10(12)8-6-9;10-8(11,9(12,13)17(14,15)16)7-4-5-1-2-6(7)3-5;1-2-3(8)5(10)7(12)6(11)4(2)9;7-6-4-2-1-3-5-6;4-1(5)2(6,7)15(11,12)10-16(13,14)3(1,8)9/h16-20H,1-15H2,(H,35,36,37);16-20H,1-15H2;16-20H,1-15H2,(H,34,35,36);16-20H,1-15H2,(H,25,26,27);1-12H;5*1-15H;8-10H,1-7H2,(H,17,18,19);5-8,12H,4H2,1-3H3;5-7H,1-4H2,(H,14,15,16);1H3;1-5,7H;/q;-1;;;6*+1;;+1;;;;-1/p-4
InChIKeyNLLYKZQXMPKBBZ-UHFFFAOYSA-J
XLogP70.25
TPSA573.03 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds57
Heavy Atoms358
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5005463.19
LogP ≤ 570.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Analyze 2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium?
The IUPAC name of 2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium (CID 159814757) is 2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium.
What is the SMILES notation for 2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium?
The canonical SMILES for 2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium is CCC(C)(C)c1ccc([IH+])cc1.Cc1c(F)c(F)c(F)c(F)c1F.Fc1ccc([S+](c2ccc(F)cc2)c2ccc(F)cc2)cc1.O=C(OCC(F)(F)S(=O)(=O)[O-])C12CC3CC(CC(C3)C1)C2.O=S(=O)([N-]S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)Oc1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1)C(F)(F)F.O=S(=O)([O-])C(F)(F)C(F)(F)C(F)(F)S(=O)(=O)Oc1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1.O=S(=O)([O-])C(F)(F)C(F)(F)C1CC2CCC1C2.O=S(=O)([O-])c1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1.O=S(=O)([O-])c1c(F)c(F)c(Oc2c(C3CCCCC3)cc(C3CCCCC3)cc2C2CCCCC2)c(F)c1F.O=S1(=O)[N-]S(=O)(=O)C(F)(F)C(F)(F)C1(F)F.[SH2+]c1ccccc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium?
The InChIKey is NLLYKZQXMPKBBZ-UHFFFAOYSA-J. The full InChI is InChI=1S/C30H36F4O4S.C28H35F9NO7S3.C27H36F6O6S2.C24H36O3S.C18H12F3S.5C18H15S.C13H18F2O5S.C11H16I.C9H12F4O3S.C7H3F5.C6H6S.C3F6NO4S2/c31-24-26(33)30(39(35,36)37)27(34)25(32)29(24)38-28-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(28)20-14-8-3-9-15-20;29-25(30,26(31,32)46(39,40)38-47(41,42)28(35,36)37)27(33,34)48(43,44)45-24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20;28-25(29,26(30,31)40(34,35)36)27(32,33)41(37,38)39-24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20;25-28(26,27)24-22(19-12-6-2-7-13-19)16-21(18-10-4-1-5-11-18)17-23(24)20-14-8-3-9-15-20;19-13-1-7-16(8-2-13)22(17-9-3-14(20)4-10-17)18-11-5-15(21)6-12-18;5*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;14-13(15,21(17,18)19)7-20-11(16)12-4-8-1-9(5-12)3-10(2-8)6-12;1-4-11(2,3)9-5-7-10(12)8-6-9;10-8(11,9(12,13)17(14,15)16)7-4-5-1-2-6(7)3-5;1-2-3(8)5(10)7(12)6(11)4(2)9;7-6-4-2-1-3-5-6;4-1(5)2(6,7)15(11,12)10-16(13,14)3(1,8)9/h16-20H,1-15H2,(H,35,36,37);16-20H,1-15H2;16-20H,1-15H2,(H,34,35,36);16-20H,1-15H2,(H,25,26,27);1-12H;5*1-15H;8-10H,1-7H2,(H,17,18,19);5-8,12H,4H2,1-3H3;5-7H,1-4H2,(H,14,15,16);1H3;1-5,7H;/q;-1;;;6*+1;;+1;;;;-1/p-4.
What are the key properties of 2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium?
2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium has a molecular weight of 5463.19 g/mol, XLogP of 70.25, 57 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;4,4,5,5,6,6-hexafluoro-1λ6,3λ6-dithia-2-azanidacyclohexane 1,1,3,3-tetraoxide;1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropane-1-sulfonate;[1,1,2,2,3,3-hexafluoro-3-(2,4,6-tricyclohexylphenoxy)sulfonylpropyl]sulfonyl-(trifluoromethylsulfonyl)azanide;[4-(2-methylbutan-2-yl)phenyl]iodanium;1,2,3,4,5-pentafluoro-6-methylbenzene;phenylsulfanium;2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate;2,4,6-tricyclohexylbenzenesulfonate;pentakis(triphenylsulfanium);tris(4-fluorophenyl)sulfanium is sourced from PubChem (CID 159814757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).