bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate

C155H134BF35O11P3S11Sb — CID 158697033

IUPACbis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate
SMILESCOc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.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.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[BH3-]c1c(F)c(F)c(F)c(F)c1F.[F-].c1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1.c1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/2C24H19S2.4C20H18OS.C19H17OS.C6H3BF5.2CHF3O3S.3F6P.6FH.Sb/c2*1-4-10-20(11-5-1)25-21-16-18-24(19-17-21)26(22-12-6-2-7-13-22)23-14-8-3-9-15-23;4*1-15-13-19(14-16(2)20(15)21)22(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-20-16-12-14-19(15-13-16)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18;7-1-2(8)4(10)6(12)5(11)3(1)9;2*2-1(3,4)8(5,6)7;3*1-7(2,3,4,5)6;;;;;;;/h2*1-19H;4*3-14H,1-2H3;2-15H,1H3;7H3;2*(H,5,6,7);;;;6*1H;/q2*+1;;;;;+1;-1;;;3*-1;;;;;;;+5/p-4
InChIKeySYPGMOUQMHPYGA-UHFFFAOYSA-J
MW3415.93 g/mol
LogP48.42
Rot. Bonds26

About bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate

bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate (PubChem CID 158697033) has the molecular formula C155H134BF35O11P3S11Sb and a molecular weight of 3415.93 g/mol. Its IUPAC name is bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate.

Molecular Properties

Compound Namebis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate
PubChem CID158697033
Molecular FormulaC155H134BF35O11P3S11Sb
Molecular Weight3415.93 g/mol
Exact Mass3412.46
IUPAC Namebis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate
SMILESCOc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.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.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[BH3-]c1c(F)c(F)c(F)c(F)c1F.[F-].c1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1.c1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1
InChIInChI=1S/2C24H19S2.4C20H18OS.C19H17OS.C6H3BF5.2CHF3O3S.3F6P.6FH.Sb/c2*1-4-10-20(11-5-1)25-21-16-18-24(19-17-21)26(22-12-6-2-7-13-22)23-14-8-3-9-15-23;4*1-15-13-19(14-16(2)20(15)21)22(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-20-16-12-14-19(15-13-16)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18;7-1-2(8)4(10)6(12)5(11)3(1)9;2*2-1(3,4)8(5,6)7;3*1-7(2,3,4,5)6;;;;;;;/h2*1-19H;4*3-14H,1-2H3;2-15H,1H3;7H3;2*(H,5,6,7);;;;6*1H;/q2*+1;;;;;+1;-1;;;3*-1;;;;;;;+5/p-4
InChIKeySYPGMOUQMHPYGA-UHFFFAOYSA-J
XLogP48.42
TPSA204.55 Ų
H-Bond Donors4
H-Bond Acceptors13
Rotatable Bonds26
Heavy Atoms217
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003415.93
LogP ≤ 548.42
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1013

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate with MolForge

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Related Compounds

bis((4-tert-butylphenyl)-diphenylsulfanium);(4-cyclohexylphenyl)-diphenylsulfanium;bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);[4-(hydroxymethyl)phenyl]-diphenylsulfanium;bis(pentafluoro-λ5-stibane);bis((2,3,4,5,6-pentafluorophenyl)boranuide);bis(trifluoromethanesulfonate);difluoride;tetrahexafluorophosphate
CID 157404442
methane;(4-methoxyphenyl)-diphenylsulfanium;trifluoromethanesulfonate;bis(triphenylsulfanium)
CID 159553561
bis(4-methylphenyl)-phenylsulfanium;(4-methoxyphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;tetrakis(trifluoromethanesulfonate);tris(4-methylphenyl)sulfanium
CID 159993942
tetrakis((4-tert-butylphenyl)-diphenylsulfanium);(4-cyclohexylphenyl)-diphenylsulfanium;bis((4-methylphenyl)-diphenylsulfanium);bis(pentafluoro-λ5-stibane);bis((2,3,4,5,6-pentafluorophenyl)boranuide);trifluoromethanesulfonate;difluoride;dihexafluorophosphate
CID 159526387
(4-benzoylphenyl)-(4-methoxyphenyl)-(4-phenylsulfanylphenyl)sulfanium;(4-benzoylphenyl)-(4-methylphenyl)-(4-phenylsulfanylphenyl)sulfanium;(4-benzoylphenyl)-(4-phenylsulfanylphenyl)-[4-(trifluoromethyl)phenyl]sulfanium;(4-methoxyphenyl)-(4-methylphenyl)-[4-(trifluoromethyl)phenyl]sulfanium;tetrahexafluorophosphate
CID 162126913
benzenesulfonate;hexakis([4-(4-diphenylsulfoniophenyl)sulfanylphenyl]-diphenylsulfanium);ethane;bis(4-methoxybenzenesulfonate);2,4,6-trimethylbenzenesulfonate
CID 157399821
1,1,2,2,3,3-hexafluorobutane-1-sulfonate;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium
CID 157388254
bis(4-methoxyphenyl)-phenylsulfanium;2,2,2-trifluoroacetate
CID 172778932
1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonate;(4-methoxyphenyl)-diphenylsulfanium
CID 22023849
(2,3,4,5,6-pentafluorophenyl)boranuide;tris[4-(4-acetylphenyl)sulfanylphenyl]sulfanium
CID 159763192
bis(4-tert-butylphenyl)-phenylsulfanium;(4-tert-butylphenyl)-diphenylsulfanium;(4-cyclohexylsulfonylphenyl)-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;(4-methoxyphenyl)-diphenylsulfanium;(4-methylphenyl)-diphenylsulfanium;triphenylsulfanium;tris(4-methylphenyl)sulfanium
CID 159442033
[4-(3-benzoyl-4-methylphenyl)sulfanylphenyl]-(4-methoxyphenyl)-[4-(trifluoromethyl)phenyl]sulfanium;hexafluoroantimony(1-)
CID 157235203

Frequently Asked Questions

What is the IUPAC name of bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate?
The IUPAC name of bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate (CID 158697033) is bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate.
What is the SMILES notation for bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate?
The canonical SMILES for bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate is COc1ccc([S+](c2ccccc2)c2ccccc2)cc1.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.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.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])C(F)(F)F.[BH3-]c1c(F)c(F)c(F)c(F)c1F.[F-].c1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1.c1ccc(Sc2ccc([S+](c3ccccc3)c3ccccc3)cc2)cc1.
What is the InChIKey of bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate?
The InChIKey is SYPGMOUQMHPYGA-UHFFFAOYSA-J. The full InChI is InChI=1S/2C24H19S2.4C20H18OS.C19H17OS.C6H3BF5.2CHF3O3S.3F6P.6FH.Sb/c2*1-4-10-20(11-5-1)25-21-16-18-24(19-17-21)26(22-12-6-2-7-13-22)23-14-8-3-9-15-23;4*1-15-13-19(14-16(2)20(15)21)22(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-20-16-12-14-19(15-13-16)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18;7-1-2(8)4(10)6(12)5(11)3(1)9;2*2-1(3,4)8(5,6)7;3*1-7(2,3,4,5)6;;;;;;;/h2*1-19H;4*3-14H,1-2H3;2-15H,1H3;7H3;2*(H,5,6,7);;;;6*1H;/q2*+1;;;;;+1;-1;;;3*-1;;;;;;;+5/p-4.
What are the key properties of bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate?
bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate has a molecular weight of 3415.93 g/mol, XLogP of 48.42, 26 rotatable bonds, 4 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for bis(diphenyl-(4-phenylsulfanylphenyl)sulfanium);tetrakis((4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium);(4-methoxyphenyl)-diphenylsulfanium;pentafluoro-λ5-stibane;(2,3,4,5,6-pentafluorophenyl)boranuide;bis(trifluoromethanesulfonate);fluoride;trihexafluorophosphate is sourced from PubChem (CID 158697033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).