bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate

C263H333B3F72O23P4S17Sb4 — CID 158869549

About bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate

bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate (PubChem CID 158869549) has the molecular formula C263H333B3F72O23P4S17Sb4 and a molecular weight of 6418.90 g/mol. Its IUPAC name is bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate.

Molecular Properties

• Compound Name: bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate
• PubChem CID: 158869549
• Molecular Formula: C263H333B3F72O23P4S17Sb4
• Molecular Weight: 6418.90 g/mol
• Exact Mass: 6411.44
• IUPAC Name: bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate
• SMILES: CCCCCCCCCCCC[S+](CCCCCCCCCCCC)CC(=O)c1ccccc1.CCCCCCCC[S+](CCCCCCCC)CC(=O)c1ccccc1.CCCC[S+](CCCC)CC(=O)c1ccccc1.CCCC[S+](CCCC)CC(=O)c1ccccc1.Cc1ccc(C(=O)C([S+]2CCCC2)C(C)(C)C)cc1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[Sb](F)(F)(F)F.F[Sb](F)(F)(F)F.F[Sb](F)(F)(F)F.F[Sb](F)(F)(F)F.O=C(C[S+]1CCCC1)c1ccc2ccccc2c1.O=C(C[S+]1CCCC1)c1ccc2ccccc2c1.O=C(C[S+]1CCCC1)c1ccc2ccccc2c1.O=C(C[S+]1CCCC1)c1ccc2ccccc2c1.O=C(c1ccccc1)C1([S+]2CCCC2)CCCCC1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.Oc1ccc([S+]2CCCC2)c2ccccc12.Oc1ccc([S+]2CCCC2)c2ccccc12.Oc1ccc([S+]2CCCC2)c2ccccc12.Oc1ccc([S+]2CCCC2)c2ccccc12.[BH3-]c1c(F)c(F)c(F)c(F)c1F.[BH3-]c1c(F)c(F)c(F)c(F)c1F.[BH3-]c1c(F)c(F)c(F)c(F)c1F.[F-].[F-].[F-].[F-]
• InChI: InChI=1S/C32H57OS.C24H41OS.C17H23OS.C17H25OS.4C16H17OS.2C16H25OS.4C14H14OS.3C6H3BF5.3CHF3O3S.4F6P.24FH.4Sb/c1-3-5-7-9-11-13-15-17-19-24-28-34(30-32(33)31-26-22-21-23-27-31)29-25-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-16-20-26(21-17-12-10-8-6-4-2)22-24(25)23-18-14-13-15-19-23;18-16(15-9-3-1-4-10-15)17(11-5-2-6-12-17)19-13-7-8-14-19;1-13-7-9-14(10-8-13)15(18)16(17(2,3)4)19-11-5-6-12-19;4*17-16(12-18-9-3-4-10-18)15-8-7-13-5-1-2-6-14(13)11-15;2*1-3-5-12-18(13-6-4-2)14-16(17)15-10-8-7-9-11-15;4*15-13-7-8-14(16-9-3-4-10-16)12-6-2-1-5-11(12)13;3*7-1-2(8)4(10)6(12)5(11)3(1)9;3*2-1(3,4)8(5,6)7;4*1-7(2,3,4,5)6;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h21-23,26-27H,3-20,24-25,28-30H2,1-2H3;13-15,18-19H,3-12,16-17,20-22H2,1-2H3;1,3-4,9-10H,2,5-8,11-14H2;7-10,16H,5-6,11-12H2,1-4H3;4*1-2,5-8,11H,3-4,9-10,12H2;2*7-11H,3-6,12-14H2,1-2H3;4*1-2,5-8H,3-4,9-10H2;3*7H3;3*(H,5,6,7);;;;;24*1H;;;;/q10*+1;;;;;3*-1;;;;4*-1;;;;;;;;;;;;;;;;;;;;;;;;;4*+5/p-23
• InChIKey: OXGJWWNNRZWJIU-UHFFFAOYSA-A
• XLogP: 70.41
• TPSA: 423.22 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 23
• Rotatable Bonds: 82
• Heavy Atoms: 386
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	6418.90
LogP ≤ 5	70.41
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate?

The IUPAC name of bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate (CID 158869549) is bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate.

What is the SMILES notation for bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate?

The canonical SMILES for bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate is CCCCCCCCCCCC[S+](CCCCCCCCCCCC)CC(=O)c1ccccc1.CCCCCCCC[S+](CCCCCCCC)CC(=O)c1ccccc1.CCCC[S+](CCCC)CC(=O)c1ccccc1.CCCC[S+](CCCC)CC(=O)c1ccccc1.Cc1ccc(C(=O)C([S+]2CCCC2)C(C)(C)C)cc1.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[P-](F)(F)(F)(F)F.F[Sb](F)(F)(F)F.F[Sb](F)(F)(F)F.F[Sb](F)(F)(F)F.F[Sb](F)(F)(F)F.O=C(C[S+]1CCCC1)c1ccc2ccccc2c1.O=C(C[S+]1CCCC1)c1ccc2ccccc2c1.O=C(C[S+]1CCCC1)c1ccc2ccccc2c1.O=C(C[S+]1CCCC1)c1ccc2ccccc2c1.O=C(c1ccccc1)C1([S+]2CCCC2)CCCCC1.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.Oc1ccc([S+]2CCCC2)c2ccccc12.Oc1ccc([S+]2CCCC2)c2ccccc12.Oc1ccc([S+]2CCCC2)c2ccccc12.Oc1ccc([S+]2CCCC2)c2ccccc12.[BH3-]c1c(F)c(F)c(F)c(F)c1F.[BH3-]c1c(F)c(F)c(F)c(F)c1F.[BH3-]c1c(F)c(F)c(F)c(F)c1F.[F-].[F-].[F-].[F-].

What is the InChIKey of bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate?

The InChIKey is OXGJWWNNRZWJIU-UHFFFAOYSA-A. The full InChI is InChI=1S/C32H57OS.C24H41OS.C17H23OS.C17H25OS.4C16H17OS.2C16H25OS.4C14H14OS.3C6H3BF5.3CHF3O3S.4F6P.24FH.4Sb/c1-3-5-7-9-11-13-15-17-19-24-28-34(30-32(33)31-26-22-21-23-27-31)29-25-20-18-16-14-12-10-8-6-4-2;1-3-5-7-9-11-16-20-26(21-17-12-10-8-6-4-2)22-24(25)23-18-14-13-15-19-23;18-16(15-9-3-1-4-10-15)17(11-5-2-6-12-17)19-13-7-8-14-19;1-13-7-9-14(10-8-13)15(18)16(17(2,3)4)19-11-5-6-12-19;4*17-16(12-18-9-3-4-10-18)15-8-7-13-5-1-2-6-14(13)11-15;2*1-3-5-12-18(13-6-4-2)14-16(17)15-10-8-7-9-11-15;4*15-13-7-8-14(16-9-3-4-10-16)12-6-2-1-5-11(12)13;3*7-1-2(8)4(10)6(12)5(11)3(1)9;3*2-1(3,4)8(5,6)7;4*1-7(2,3,4,5)6;;;;;;;;;;;;;;;;;;;;;;;;;;;;/h21-23,26-27H,3-20,24-25,28-30H2,1-2H3;13-15,18-19H,3-12,16-17,20-22H2,1-2H3;1,3-4,9-10H,2,5-8,11-14H2;7-10,16H,5-6,11-12H2,1-4H3;4*1-2,5-8,11H,3-4,9-10,12H2;2*7-11H,3-6,12-14H2,1-2H3;4*1-2,5-8H,3-4,9-10H2;3*7H3;3*(H,5,6,7);;;;;24*1H;;;;/q10*+1;;;;;3*-1;;;;4*-1;;;;;;;;;;;;;;;;;;;;;;;;;4*+5/p-23.

What are the key properties of bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate?

bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate has a molecular weight of 6418.90 g/mol, XLogP of 70.41, 82 rotatable bonds, 4 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for bis(dibutyl(phenacyl)sulfanium);didodecyl(phenacyl)sulfanium;3,3-dimethyl-1-(4-methylphenyl)-2-(thiolan-1-ium-1-yl)butan-1-one;dioctyl(phenacyl)sulfanium;tetrakis(1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone);tetrakis(pentafluoro-λ5-stibane);tris((2,3,4,5,6-pentafluorophenyl)boranuide);phenyl-[1-(thiolan-1-ium-1-yl)cyclohexyl]methanone;tetrakis(4-(thiolan-1-ium-1-yl)naphthalen-1-ol);tris(trifluoromethanesulfonate);tetrafluoride;tetrahexafluorophosphate is sourced from PubChem (CID 158869549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).