bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium

C190H180F9O6S9+9 — CID 161025551

IUPACbis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium
SMILESCC(C)(C)c1ccc([S+](c2ccc(C(C)(C)C)cc2)c2ccc(C(C)(C)C)cc2)cc1.CC(C)(C)c1ccc([S+](c2ccccc2)c2ccc(O)cc2)cc1.CCOC(C)(COc1ccc([S+](c2ccccc2)c2ccccc2)cc1)C(F)(F)F.COC(=O)c1ccccc1[S+](c1ccccc1)c1ccccc1.Cc1ccc([S+](c2ccccc2)c2ccc(C)cc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.FC(F)(F)c1cccc([S+](c2ccccc2)c2ccccc2)c1.Fc1ccc([S+](c2ccccc2)c2ccccc2)cc1F.Oc1cc(F)ccc1[S+](c1ccccc1)c1ccccc1
InChIInChI=1S/C30H39S.C24H24F3O2S.C22H22OS.C20H17O2S.C20H19S.C19H14F3S.C19H17S.C18H13F2S.C18H13FOS/c1-28(2,3)22-10-16-25(17-11-22)31(26-18-12-23(13-19-26)29(4,5)6)27-20-14-24(15-21-27)30(7,8)9;1-3-29-23(2,24(25,26)27)18-28-19-14-16-22(17-15-19)30(20-10-6-4-7-11-20)21-12-8-5-9-13-21;1-22(2,3)17-9-13-20(14-10-17)24(19-7-5-4-6-8-19)21-15-11-18(23)12-16-21;1-22-20(21)18-14-8-9-15-19(18)23(16-10-4-2-5-11-16)17-12-6-3-7-13-17;1-16-8-12-19(13-9-16)21(18-6-4-3-5-7-18)20-14-10-17(2)11-15-20;20-19(21,22)15-8-7-13-18(14-15)23(16-9-3-1-4-10-16)17-11-5-2-6-12-17;1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18;19-17-12-11-16(13-18(17)20)21(14-7-3-1-4-8-14)15-9-5-2-6-10-15;19-14-11-12-18(17(20)13-14)21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h10-21H,1-9H3;4-17H,3,18H2,1-2H3;4-16H,1-3H3;2-15H,1H3;3-15H,1-2H3;1-14H;2-15H,1H3;2*1-13H/q2*+1;;5*+1;/p+2
InChIKeyTYXSRUVLHIOMCL-UHFFFAOYSA-P
MW3019.11 g/mol
LogP51.52
Rot. Bonds33

About bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium

bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium (PubChem CID 161025551) has the molecular formula C190H180F9O6S9+9 and a molecular weight of 3019.11 g/mol. Its IUPAC name is bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium.

Molecular Properties

Compound Namebis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium
PubChem CID161025551
Molecular FormulaC190H180F9O6S9+9
Molecular Weight3019.11 g/mol
Exact Mass3016.11
IUPAC Namebis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium
SMILESCC(C)(C)c1ccc([S+](c2ccc(C(C)(C)C)cc2)c2ccc(C(C)(C)C)cc2)cc1.CC(C)(C)c1ccc([S+](c2ccccc2)c2ccc(O)cc2)cc1.CCOC(C)(COc1ccc([S+](c2ccccc2)c2ccccc2)cc1)C(F)(F)F.COC(=O)c1ccccc1[S+](c1ccccc1)c1ccccc1.Cc1ccc([S+](c2ccccc2)c2ccc(C)cc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.FC(F)(F)c1cccc([S+](c2ccccc2)c2ccccc2)c1.Fc1ccc([S+](c2ccccc2)c2ccccc2)cc1F.Oc1cc(F)ccc1[S+](c1ccccc1)c1ccccc1
InChIInChI=1S/C30H39S.C24H24F3O2S.C22H22OS.C20H17O2S.C20H19S.C19H14F3S.C19H17S.C18H13F2S.C18H13FOS/c1-28(2,3)22-10-16-25(17-11-22)31(26-18-12-23(13-19-26)29(4,5)6)27-20-14-24(15-21-27)30(7,8)9;1-3-29-23(2,24(25,26)27)18-28-19-14-16-22(17-15-19)30(20-10-6-4-7-11-20)21-12-8-5-9-13-21;1-22(2,3)17-9-13-20(14-10-17)24(19-7-5-4-6-8-19)21-15-11-18(23)12-16-21;1-22-20(21)18-14-8-9-15-19(18)23(16-10-4-2-5-11-16)17-12-6-3-7-13-17;1-16-8-12-19(13-9-16)21(18-6-4-3-5-7-18)20-14-10-17(2)11-15-20;20-19(21,22)15-8-7-13-18(14-15)23(16-9-3-1-4-10-16)17-11-5-2-6-12-17;1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18;19-17-12-11-16(13-18(17)20)21(14-7-3-1-4-8-14)15-9-5-2-6-10-15;19-14-11-12-18(17(20)13-14)21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h10-21H,1-9H3;4-17H,3,18H2,1-2H3;4-16H,1-3H3;2-15H,1H3;3-15H,1-2H3;1-14H;2-15H,1H3;2*1-13H/q2*+1;;5*+1;/p+2
InChIKeyTYXSRUVLHIOMCL-UHFFFAOYSA-P
XLogP51.52
TPSA85.22 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds33
Heavy Atoms214
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003019.11
LogP ≤ 551.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}

Analyze bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium with MolForge

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Related Compounds

2-Acetyloxy-1,1-difluoropropane-1-sulfonate;bis(2-(adamantane-1-carbonyloxy)-1,1-difluoropropane-1-sulfonate);(4-tert-butylphenyl)-diphenylsulfanium;2-(cyclohexanecarbonyloxy)-1,1-difluoropropane-1-sulfonate;(3,5-dimethylphenyl)-diphenylsulfanium;tetrakis(2-(2,2-dimethylpropanoyloxy)-1,1-difluoropropane-1-sulfonate);bis((4-fluorophenyl)-diphenylsulfanium);(4-hydroxyphenyl)-diphenylsulfanium;methane;(4-methylphenyl)-diphenylsulfanium;[4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;naphthalen-1-yl(diphenyl)sulfanium
CID 158012043
2-Acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;bis(2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate);(4-tert-butylphenyl)-diphenylsulfanium;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;(3,5-dimethylphenyl)-diphenylsulfanium;tetrakis(2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate);2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;bis((4-fluorophenyl)-diphenylsulfanium);bis((4-hydroxyphenyl)-diphenylsulfanium);(4-methylphenyl)-diphenylsulfanium;[4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;naphthalen-1-yl(diphenyl)sulfanium
CID 158759391
CID 159209584
CID 159209584
2-Acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;tris(2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate);(4-tert-butylphenyl)-diphenylsulfanium;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;(3,5-dimethylphenyl)-diphenylsulfanium;bis(2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate);2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;bis((4-fluorophenyl)-diphenylsulfanium);(4-hydroxyphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;[4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;5-phenyldibenzothiophen-5-ium
CID 159307297
2-Acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;bis(2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate);bis((4-tert-butylphenyl)-diphenylsulfanium);2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;(3,5-dimethylphenyl)-diphenylsulfanium;pentakis(2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate);2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;bis((4-fluorophenyl)-diphenylsulfanium);bis((4-hydroxyphenyl)-diphenylsulfanium);(4-methylphenyl)-diphenylsulfanium;[4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;naphthalen-1-yl(diphenyl)sulfanium
CID 159885541
2-Acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;bis(2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate);bis((4-tert-butylphenyl)-diphenylsulfanium);2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;(3,5-dimethylphenyl)-diphenylsulfanium;hexakis(2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate);2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;bis((4-fluorophenyl)-diphenylsulfanium);bis((4-hydroxyphenyl)-diphenylsulfanium);bis((4-methylphenyl)-diphenylsulfanium);[4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;naphthalen-1-yl(diphenyl)sulfanium
CID 160360907
2-Acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;bis(2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate);(4-tert-butylphenyl)-diphenylsulfanium;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;(3,5-dimethylphenyl)-diphenylsulfanium;tris(2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate);2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;bis((4-fluorophenyl)-diphenylsulfanium);(4-hydroxyphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;[4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;naphthalen-1-yl(diphenyl)sulfanium
CID 160715987
2-Acetyloxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;tetrakis(2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate);(4-tert-butylphenyl)-diphenylsulfanium;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;(3,5-dimethylphenyl)-diphenylsulfanium;bis(2-(2,2-dimethylpropanoyloxy)-1,1-difluoroethanesulfonate);2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;bis((4-fluorophenyl)-diphenylsulfanium);(4-hydroxyphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;[4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;5-phenyldibenzothiophen-5-ium;10-phenylphenoxathiin-10-ium
CID 161258338
[4-(2,2-Dimethylpropanoyl)phenyl]-diphenylsulfanium;tetrakis(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonate);(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;(4-methoxy-3,5-dimethylphenyl)-diphenylsulfanium;4-methylbenzenesulfonate;tetrakis([4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]-diphenylsulfanium);2,3,4,5,6-pentafluorobenzenesulfonate;trifluoromethanesulfonate
CID 161291327
Tris(2-(adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate);(4-tert-butylphenyl)-diphenylsulfanium;2-(cyclohexanecarbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(2,2-dimethylpropanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;(4-fluorophenyl)-diphenylsulfanium;(4-hydroxyphenyl)-diphenylsulfanium;[4-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;5-phenyldibenzothiophen-5-ium;10-phenylphenoxathiin-10-ium
CID 161365300
[4-(4-Tert-butylbenzoyl)oxyphenyl]-diphenylsulfanium;[4-(2,4-difluorobenzoyl)oxyphenyl]-diphenylsulfanium;diphenyl-[4-(4-propan-2-ylbenzoyl)oxyphenyl]sulfanium;diphenyl-[4-[4-(trifluoromethyl)benzoyl]oxyphenyl]sulfanium;[4-(4-fluorobenzoyl)oxyphenyl]-diphenylsulfanium;[4-(4-methylbenzoyl)oxyphenyl]-diphenylsulfanium;[4-[2-oxo-2-(2,3,4,5,6-pentafluorophenoxy)ethoxy]phenyl]-diphenylsulfanium
CID 161781253
[4-(4-Tert-butylbenzoyl)oxyphenyl]-diphenylsulfanium;[4-(2,4-difluorobenzoyl)oxyphenyl]-diphenylsulfanium;[4-(3,5-difluorobenzoyl)oxyphenyl]-diphenylsulfanium;diphenyl-[4-[4-(trifluoromethyl)benzoyl]oxyphenyl]sulfanium;[4-(4-fluorobenzoyl)oxyphenyl]-diphenylsulfanium;[4-(2,3,4,5,6-pentafluorobenzoyl)oxyphenyl]-diphenylsulfanium
CID 161820481

Frequently Asked Questions

What is the IUPAC name of bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium?
The IUPAC name of bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium (CID 161025551) is bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium.
What is the SMILES notation for bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium?
The canonical SMILES for bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium is CC(C)(C)c1ccc([S+](c2ccc(C(C)(C)C)cc2)c2ccc(C(C)(C)C)cc2)cc1.CC(C)(C)c1ccc([S+](c2ccccc2)c2ccc(O)cc2)cc1.CCOC(C)(COc1ccc([S+](c2ccccc2)c2ccccc2)cc1)C(F)(F)F.COC(=O)c1ccccc1[S+](c1ccccc1)c1ccccc1.Cc1ccc([S+](c2ccccc2)c2ccc(C)cc2)cc1.Cc1ccc([S+](c2ccccc2)c2ccccc2)cc1.FC(F)(F)c1cccc([S+](c2ccccc2)c2ccccc2)c1.Fc1ccc([S+](c2ccccc2)c2ccccc2)cc1F.Oc1cc(F)ccc1[S+](c1ccccc1)c1ccccc1.
What is the InChIKey of bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium?
The InChIKey is TYXSRUVLHIOMCL-UHFFFAOYSA-P. The full InChI is InChI=1S/C30H39S.C24H24F3O2S.C22H22OS.C20H17O2S.C20H19S.C19H14F3S.C19H17S.C18H13F2S.C18H13FOS/c1-28(2,3)22-10-16-25(17-11-22)31(26-18-12-23(13-19-26)29(4,5)6)27-20-14-24(15-21-27)30(7,8)9;1-3-29-23(2,24(25,26)27)18-28-19-14-16-22(17-15-19)30(20-10-6-4-7-11-20)21-12-8-5-9-13-21;1-22(2,3)17-9-13-20(14-10-17)24(19-7-5-4-6-8-19)21-15-11-18(23)12-16-21;1-22-20(21)18-14-8-9-15-19(18)23(16-10-4-2-5-11-16)17-12-6-3-7-13-17;1-16-8-12-19(13-9-16)21(18-6-4-3-5-7-18)20-14-10-17(2)11-15-20;20-19(21,22)15-8-7-13-18(14-15)23(16-9-3-1-4-10-16)17-11-5-2-6-12-17;1-16-12-14-19(15-13-16)20(17-8-4-2-5-9-17)18-10-6-3-7-11-18;19-17-12-11-16(13-18(17)20)21(14-7-3-1-4-8-14)15-9-5-2-6-10-15;19-14-11-12-18(17(20)13-14)21(15-7-3-1-4-8-15)16-9-5-2-6-10-16/h10-21H,1-9H3;4-17H,3,18H2,1-2H3;4-16H,1-3H3;2-15H,1H3;3-15H,1-2H3;1-14H;2-15H,1H3;2*1-13H/q2*+1;;5*+1;/p+2.
What are the key properties of bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium?
bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium has a molecular weight of 3019.11 g/mol, XLogP of 51.52, 33 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-methylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-(4-hydroxyphenyl)-phenylsulfanium;(3,4-difluorophenyl)-diphenylsulfanium;diphenyl-[3-(trifluoromethyl)phenyl]sulfanium;[4-(2-ethoxy-3,3,3-trifluoro-2-methylpropoxy)phenyl]-diphenylsulfanium;(4-fluoro-2-hydroxyphenyl)-diphenylsulfanium;(2-methoxycarbonylphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tris(4-tert-butylphenyl)sulfanium is sourced from PubChem (CID 161025551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).