2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium)

C304H315F47O52S20 — CID 158158401

IUPAC2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium)
SMILESCC(=O)OC1CC2CC1CC2C(F)(F)C(F)(F)S(=O)(=O)[O-].CC(C)(C)OC(=O)OC1CC2CC1CC2C(F)(F)C(F)(F)S(=O)(=O)O.CCCCOc1c[c-]c([S+]2CCCC2)c2ccccc12.CCCCOc1ccc([S+]2CCCC2)c2ccccc12.CCCCOc1ccc([S+]2CCCC2)c2ccccc12.O=C(O)C1CCCCC1C(=O)OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-].O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])C12CC3CC(CC(C3)C1)C2.O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])C1CC2CC1C1C3CCC(C3)C21.O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])C1CCCCC1.O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])c1ccccc1.O=S(=O)([O-])C(C1CC2CC(O)C1C2)(C(F)(F)F)C(F)(F)F.O=S(=O)([O-])C(F)(F)C(F)(F)C1CC2CC1C1C3CC(O)C(C3)C21.O=S(=O)([O-])C(F)(F)C(F)(F)C1CC2CC1C1C3CCC(C3)C21.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.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C18H23OS.C18H22OS.7C18H15S.C16H19F5O5S.C14H17F5O5S.C14H20F4O6S.C14H18F4O4S.C14H18F4O3S.C11H13F5O7S.C11H14F4O5S.C10H12F6O4S.C10H13F5O5S.C10H7F5O5S/c3*1-2-3-12-19-17-10-11-18(20-13-6-7-14-20)16-9-5-4-8-15(16)17;7*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;17-15(18,19)14(16(20,21)27(23,24)25)26-13(22)10-5-8-4-9(10)12-7-2-1-6(3-7)11(8)12;15-13(16,17)10(14(18,19)25(21,22)23)24-11(20)12-4-7-1-8(5-12)3-9(2-7)6-12;1-12(2,3)24-11(19)23-10-6-7-4-8(10)5-9(7)13(15,16)14(17,18)25(20,21)22;15-13(16,14(17,18)23(20,21)22)9-3-5-1-7(9)11-6-2-8(12(5)11)10(19)4-6;15-13(16,14(17,18)22(19,20)21)10-5-8-4-9(10)12-7-2-1-6(3-7)11(8)12;12-10(13,14)9(11(15,16)24(20,21)22)23-8(19)6-4-2-1-3-5(6)7(17)18;1-5(16)20-9-4-6-2-7(9)3-8(6)10(12,13)11(14,15)21(17,18)19;11-9(12,13)8(10(14,15)16,21(18,19)20)6-2-4-1-5(6)7(17)3-4;2*11-9(12,13)8(10(14,15)21(17,18)19)20-7(16)6-4-2-1-3-5-6/h2*4-5,8-11H,2-3,6-7,12-14H2,1H3;4-5,8-10H,2-3,6-7,12-14H2,1H3;7*1-15H;6-12,14H,1-5H2,(H,23,24,25);7-10H,1-6H2,(H,21,22,23);7-10H,4-6H2,1-3H3,(H,20,21,22);5-12,19H,1-4H2,(H,20,21,22);6-12H,1-5H2,(H,19,20,21);5-6,9H,1-4H2,(H,17,18)(H,20,21,22);6-9H,2-4H2,1H3,(H,17,18,19);4-7,17H,1-3H2,(H,18,19,20);6,8H,1-5H2,(H,17,18,19);1-5,8H,(H,17,18,19)/q2*+1;;7*+1;;;;;;;;;;/p-9
InChIKeyFVYYWNJJHGTOSQ-UHFFFAOYSA-E
MW6335.06 g/mol
LogP71.09
Rot. Bonds73

About 2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium)

2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium) (PubChem CID 158158401) has the molecular formula C304H315F47O52S20 and a molecular weight of 6335.06 g/mol. Its IUPAC name is 2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium).

Molecular Properties

Compound Name2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium)
PubChem CID158158401
Molecular FormulaC304H315F47O52S20
Molecular Weight6335.06 g/mol
Exact Mass6329.57
IUPAC Name2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium)
SMILESCC(=O)OC1CC2CC1CC2C(F)(F)C(F)(F)S(=O)(=O)[O-].CC(C)(C)OC(=O)OC1CC2CC1CC2C(F)(F)C(F)(F)S(=O)(=O)O.CCCCOc1c[c-]c([S+]2CCCC2)c2ccccc12.CCCCOc1ccc([S+]2CCCC2)c2ccccc12.CCCCOc1ccc([S+]2CCCC2)c2ccccc12.O=C(O)C1CCCCC1C(=O)OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-].O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])C12CC3CC(CC(C3)C1)C2.O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])C1CC2CC1C1C3CCC(C3)C21.O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])C1CCCCC1.O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])c1ccccc1.O=S(=O)([O-])C(C1CC2CC(O)C1C2)(C(F)(F)F)C(F)(F)F.O=S(=O)([O-])C(F)(F)C(F)(F)C1CC2CC1C1C3CC(O)C(C3)C21.O=S(=O)([O-])C(F)(F)C(F)(F)C1CC2CC1C1C3CCC(C3)C21.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.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/2C18H23OS.C18H22OS.7C18H15S.C16H19F5O5S.C14H17F5O5S.C14H20F4O6S.C14H18F4O4S.C14H18F4O3S.C11H13F5O7S.C11H14F4O5S.C10H12F6O4S.C10H13F5O5S.C10H7F5O5S/c3*1-2-3-12-19-17-10-11-18(20-13-6-7-14-20)16-9-5-4-8-15(16)17;7*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;17-15(18,19)14(16(20,21)27(23,24)25)26-13(22)10-5-8-4-9(10)12-7-2-1-6(3-7)11(8)12;15-13(16,17)10(14(18,19)25(21,22)23)24-11(20)12-4-7-1-8(5-12)3-9(2-7)6-12;1-12(2,3)24-11(19)23-10-6-7-4-8(10)5-9(7)13(15,16)14(17,18)25(20,21)22;15-13(16,14(17,18)23(20,21)22)9-3-5-1-7(9)11-6-2-8(12(5)11)10(19)4-6;15-13(16,14(17,18)22(19,20)21)10-5-8-4-9(10)12-7-2-1-6(3-7)11(8)12;12-10(13,14)9(11(15,16)24(20,21)22)23-8(19)6-4-2-1-3-5(6)7(17)18;1-5(16)20-9-4-6-2-7(9)3-8(6)10(12,13)11(14,15)21(17,18)19;11-9(12,13)8(10(14,15)16,21(18,19)20)6-2-4-1-5(6)7(17)3-4;2*11-9(12,13)8(10(14,15)21(17,18)19)20-7(16)6-4-2-1-3-5-6/h2*4-5,8-11H,2-3,6-7,12-14H2,1H3;4-5,8-10H,2-3,6-7,12-14H2,1H3;7*1-15H;6-12,14H,1-5H2,(H,23,24,25);7-10H,1-6H2,(H,21,22,23);7-10H,4-6H2,1-3H3,(H,20,21,22);5-12,19H,1-4H2,(H,20,21,22);6-12H,1-5H2,(H,19,20,21);5-6,9H,1-4H2,(H,17,18)(H,20,21,22);6-9H,2-4H2,1H3,(H,17,18,19);4-7,17H,1-3H2,(H,18,19,20);6,8H,1-5H2,(H,17,18,19);1-5,8H,(H,17,18,19)/q2*+1;;7*+1;;;;;;;;;;/p-9
InChIKeyFVYYWNJJHGTOSQ-UHFFFAOYSA-E
XLogP71.09
TPSA867.95 Ų
H-Bond Donors4
H-Bond Acceptors50
Rotatable Bonds73
Heavy Atoms423
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5006335.06
LogP ≤ 571.09
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1050

Analyze 2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium)?
The IUPAC name of 2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium) (CID 158158401) is 2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium).
What is the SMILES notation for 2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium)?
The canonical SMILES for 2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium) is CC(=O)OC1CC2CC1CC2C(F)(F)C(F)(F)S(=O)(=O)[O-].CC(C)(C)OC(=O)OC1CC2CC1CC2C(F)(F)C(F)(F)S(=O)(=O)O.CCCCOc1c[c-]c([S+]2CCCC2)c2ccccc12.CCCCOc1ccc([S+]2CCCC2)c2ccccc12.CCCCOc1ccc([S+]2CCCC2)c2ccccc12.O=C(O)C1CCCCC1C(=O)OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-].O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])C12CC3CC(CC(C3)C1)C2.O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])C1CC2CC1C1C3CCC(C3)C21.O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])C1CCCCC1.O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])c1ccccc1.O=S(=O)([O-])C(C1CC2CC(O)C1C2)(C(F)(F)F)C(F)(F)F.O=S(=O)([O-])C(F)(F)C(F)(F)C1CC2CC1C1C3CC(O)C(C3)C21.O=S(=O)([O-])C(F)(F)C(F)(F)C1CC2CC1C1C3CCC(C3)C21.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.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium)?
The InChIKey is FVYYWNJJHGTOSQ-UHFFFAOYSA-E. The full InChI is InChI=1S/2C18H23OS.C18H22OS.7C18H15S.C16H19F5O5S.C14H17F5O5S.C14H20F4O6S.C14H18F4O4S.C14H18F4O3S.C11H13F5O7S.C11H14F4O5S.C10H12F6O4S.C10H13F5O5S.C10H7F5O5S/c3*1-2-3-12-19-17-10-11-18(20-13-6-7-14-20)16-9-5-4-8-15(16)17;7*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;17-15(18,19)14(16(20,21)27(23,24)25)26-13(22)10-5-8-4-9(10)12-7-2-1-6(3-7)11(8)12;15-13(16,17)10(14(18,19)25(21,22)23)24-11(20)12-4-7-1-8(5-12)3-9(2-7)6-12;1-12(2,3)24-11(19)23-10-6-7-4-8(10)5-9(7)13(15,16)14(17,18)25(20,21)22;15-13(16,14(17,18)23(20,21)22)9-3-5-1-7(9)11-6-2-8(12(5)11)10(19)4-6;15-13(16,14(17,18)22(19,20)21)10-5-8-4-9(10)12-7-2-1-6(3-7)11(8)12;12-10(13,14)9(11(15,16)24(20,21)22)23-8(19)6-4-2-1-3-5(6)7(17)18;1-5(16)20-9-4-6-2-7(9)3-8(6)10(12,13)11(14,15)21(17,18)19;11-9(12,13)8(10(14,15)16,21(18,19)20)6-2-4-1-5(6)7(17)3-4;2*11-9(12,13)8(10(14,15)21(17,18)19)20-7(16)6-4-2-1-3-5-6/h2*4-5,8-11H,2-3,6-7,12-14H2,1H3;4-5,8-10H,2-3,6-7,12-14H2,1H3;7*1-15H;6-12,14H,1-5H2,(H,23,24,25);7-10H,1-6H2,(H,21,22,23);7-10H,4-6H2,1-3H3,(H,20,21,22);5-12,19H,1-4H2,(H,20,21,22);6-12H,1-5H2,(H,19,20,21);5-6,9H,1-4H2,(H,17,18)(H,20,21,22);6-9H,2-4H2,1H3,(H,17,18,19);4-7,17H,1-3H2,(H,18,19,20);6,8H,1-5H2,(H,17,18,19);1-5,8H,(H,17,18,19)/q2*+1;;7*+1;;;;;;;;;;/p-9.
What are the key properties of 2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium)?
2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium) has a molecular weight of 6335.06 g/mol, XLogP of 71.09, 73 rotatable bonds, 4 hydrogen bond donors, and 50 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-acetyloxy-2-bicyclo[2.2.1]heptanyl)-1,1,2,2-tetrafluoroethanesulfonate;2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-benzoyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1-(4-butoxy-2H-naphthalen-2-id-1-yl)thiolan-1-ium;bis(1-(4-butoxynaphthalen-1-yl)thiolan-1-ium);2-(2-carboxycyclohexanecarbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,1,3,3,3-hexafluoro-2-(6-hydroxy-2-bicyclo[2.2.1]heptanyl)propane-2-sulfonate;1,1,3,3,3-pentafluoro-2-(tetracyclo[6.2.1.13,6.02,7]dodecane-4-carbonyloxy)propane-1-sulfonate;1,1,2,2-tetrafluoro-2-(9-hydroxy-4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;1,1,2,2-tetrafluoro-2-[5-[(2-methylpropan-2-yl)oxycarbonyloxy]-2-bicyclo[2.2.1]heptanyl]ethanesulfonic acid;1,1,2,2-tetrafluoro-2-(4-tetracyclo[6.2.1.13,6.02,7]dodecanyl)ethanesulfonate;heptakis(triphenylsulfanium) is sourced from PubChem (CID 158158401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).