2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium)

C240H235F27O46S18 — CID 157160248

About 2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium)

2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium) (PubChem CID 157160248) has the molecular formula C240H235F27O46S18 and a molecular weight of 4945.63 g/mol. Its IUPAC name is 2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium).

Molecular Properties

• Compound Name: 2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium)
• PubChem CID: 157160248
• Molecular Formula: C240H235F27O46S18
• Molecular Weight: 4945.63 g/mol
• Exact Mass: 4941.06
• IUPAC Name: 2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium)
• SMILES: C.CC(=O)OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-].CC(=O)OCC(F)(F)S(=O)(=O)[O-].CC(C)(C)C(=O)OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-].CC(C)(C)C(=O)OCC(F)(F)S(=O)(=O)[O-].O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])C1CCCCC1.O=C(OCC(F)(F)S(=O)(=O)[O-])C12CC3CC(CC(C3)C1)C2.O=C(OCC(F)(F)S(=O)(=O)[O-])C1C2CC3CC(=O)C1C3C2.O=C(OCC(F)(F)S(=O)(=O)[O-])C1CC=CCC1.O=C(OCC(F)(F)S(=O)(=O)[O-])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.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1
• InChI: InChI=1S/9C18H15S.C13H18F2O5S.C12H14F2O6S.C10H13F5O5S.C9H14F2O5S.C9H12F2O5S.C8H11F5O5S.C7H12F2O5S.C5H5F5O5S.C4H6F2O5S.CH4/c9*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;13-12(14,21(17,18)19)4-20-11(16)9-6-1-5-3-8(15)10(9)7(5)2-6;11-9(12,13)8(10(14,15)21(17,18)19)20-7(16)6-4-2-1-3-5-6;2*10-9(11,17(13,14)15)6-16-8(12)7-4-2-1-3-5-7;1-6(2,3)5(14)18-4(7(9,10)11)8(12,13)19(15,16)17;1-6(2,3)5(10)14-4-7(8,9)15(11,12)13;1-2(11)15-3(4(6,7)8)5(9,10)16(12,13)14;1-3(7)11-2-4(5,6)12(8,9)10;/h9*1-15H;8-10H,1-7H2,(H,17,18,19);5-7,9-10H,1-4H2,(H,17,18,19);6,8H,1-5H2,(H,17,18,19);7H,1-6H2,(H,13,14,15);1-2,7H,3-6H2,(H,13,14,15);4H,1-3H3,(H,15,16,17);4H2,1-3H3,(H,11,12,13);3H,1H3,(H,12,13,14);2H2,1H3,(H,8,9,10);1H4/q9*+1;;;;;;;;;;/p-9
• InChIKey: AMHDIVOVAJYOEX-UHFFFAOYSA-E
• XLogP: 53.20
• TPSA: 768.57 Ų
• H-Bond Acceptors: 46
• Rotatable Bonds: 59
• Heavy Atoms: 331
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	4945.63
LogP ≤ 5	53.20
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	46

Frequently Asked Questions

What is the IUPAC name of 2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium)?

The IUPAC name of 2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium) (CID 157160248) is 2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium).

What is the SMILES notation for 2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium)?

The canonical SMILES for 2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium) is C.CC(=O)OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-].CC(=O)OCC(F)(F)S(=O)(=O)[O-].CC(C)(C)C(=O)OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-].CC(C)(C)C(=O)OCC(F)(F)S(=O)(=O)[O-].O=C(OC(C(F)(F)F)C(F)(F)S(=O)(=O)[O-])C1CCCCC1.O=C(OCC(F)(F)S(=O)(=O)[O-])C12CC3CC(CC(C3)C1)C2.O=C(OCC(F)(F)S(=O)(=O)[O-])C1C2CC3CC(=O)C1C3C2.O=C(OCC(F)(F)S(=O)(=O)[O-])C1CC=CCC1.O=C(OCC(F)(F)S(=O)(=O)[O-])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.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-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium)?

The InChIKey is AMHDIVOVAJYOEX-UHFFFAOYSA-E. The full InChI is InChI=1S/9C18H15S.C13H18F2O5S.C12H14F2O6S.C10H13F5O5S.C9H14F2O5S.C9H12F2O5S.C8H11F5O5S.C7H12F2O5S.C5H5F5O5S.C4H6F2O5S.CH4/c9*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;13-12(14,21(17,18)19)4-20-11(16)9-6-1-5-3-8(15)10(9)7(5)2-6;11-9(12,13)8(10(14,15)21(17,18)19)20-7(16)6-4-2-1-3-5-6;2*10-9(11,17(13,14)15)6-16-8(12)7-4-2-1-3-5-7;1-6(2,3)5(14)18-4(7(9,10)11)8(12,13)19(15,16)17;1-6(2,3)5(10)14-4-7(8,9)15(11,12)13;1-2(11)15-3(4(6,7)8)5(9,10)16(12,13)14;1-3(7)11-2-4(5,6)12(8,9)10;/h9*1-15H;8-10H,1-7H2,(H,17,18,19);5-7,9-10H,1-4H2,(H,17,18,19);6,8H,1-5H2,(H,17,18,19);7H,1-6H2,(H,13,14,15);1-2,7H,3-6H2,(H,13,14,15);4H,1-3H3,(H,15,16,17);4H2,1-3H3,(H,11,12,13);3H,1H3,(H,12,13,14);2H2,1H3,(H,8,9,10);1H4/q9*+1;;;;;;;;;;/p-9.

What are the key properties of 2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium)?

2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium) has a molecular weight of 4945.63 g/mol, XLogP of 53.20, 59 rotatable bonds, 0 hydrogen bond donors, and 46 hydrogen bond acceptors.

Where does this data come from?

All data for 2-acetyloxy-1,1-difluoroethanesulfonate;2-acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1-difluoroethanesulfonate;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(cyclohex-3-ene-1-carbonyloxy)-1,1-difluoroethanesulfonate;1,1-difluoro-2-(4-oxotricyclo[4.2.1.03,7]nonane-2-carbonyl)oxyethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;nonakis(triphenylsulfanium) is sourced from PubChem (CID 157160248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).