bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium

C202H172F22O8S10+10 — CID 158849909

IUPACbis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium
SMILESCC(C)(C)Oc1cc(F)ccc1[S+](c1ccccc1)c1ccccc1.CC(C)(C)Oc1cc([S+](c2ccccc2)c2ccccc2)ccc1F.Cc1cc([S+](c2ccccc2)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc(C(F)(F)F)c1.Cc1cc([S+](c2ccccc2)c2cc(C)c(O)c(C)c2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.FC(F)(F)Oc1ccc([S+](c2ccccc2)c2ccccc2)cc1.FC(F)(F)c1ccc([S+](c2ccccc2)c2ccccc2)cc1.Oc1cc([S+](c2ccccc2)c2ccccc2)ccc1F.Oc1ccc([S+](c2ccccc2)c2ccccc2)cc1F
InChIInChI=1S/C22H14F9S.2C22H22FOS.C22H22O2S.C20H16F3S.C20H18OS.C19H14F3OS.C19H14F3S.2C18H13FOS/c1-13-7-14(20(23,24)25)10-18(8-13)32(17-5-3-2-4-6-17)19-11-15(21(26,27)28)9-16(12-19)22(29,30)31;1-22(2,3)24-20-16-17(23)14-15-21(20)25(18-10-6-4-7-11-18)19-12-8-5-9-13-19;1-22(2,3)24-21-16-19(14-15-20(21)23)25(17-10-6-4-7-11-17)18-12-8-5-9-13-18;1-14-10-19(11-15(2)21(14)23)25(18-8-6-5-7-9-18)20-12-16(3)22(24)17(4)13-20;1-15-12-16(20(21,22)23)14-19(13-15)24(17-8-4-2-5-9-17)18-10-6-3-7-11-18;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;20-19(21,22)23-15-11-13-18(14-12-15)24(16-7-3-1-4-8-16)17-9-5-2-6-10-17;20-19(21,22)15-11-13-18(14-12-15)23(16-7-3-1-4-8-16)17-9-5-2-6-10-17;19-17-13-16(11-12-18(17)20)21(14-7-3-1-4-8-14)15-9-5-2-6-10-15;19-17-12-11-16(13-18(17)20)21(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h2-12H,1H3;2*4-16H,1-3H3;5-13H,1-4H3,(H-,23,24);2-14H,1H3;3-14H,1-2H3;1-14H;1-14H;2*1-13H/q3*+1;;+1;;2*+1;;/p+4
InChIKeyIZHVPTKRHGLCMR-UHFFFAOYSA-R
MW3466.22 g/mol
LogP57.72
Rot. Bonds33

About bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium

bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium (PubChem CID 158849909) has the molecular formula C202H172F22O8S10+10 and a molecular weight of 3466.22 g/mol. Its IUPAC name is bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium.

Molecular Properties

Compound Namebis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium
PubChem CID158849909
Molecular FormulaC202H172F22O8S10+10
Molecular Weight3466.22 g/mol
Exact Mass3462.99
IUPAC Namebis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium
SMILESCC(C)(C)Oc1cc(F)ccc1[S+](c1ccccc1)c1ccccc1.CC(C)(C)Oc1cc([S+](c2ccccc2)c2ccccc2)ccc1F.Cc1cc([S+](c2ccccc2)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc(C(F)(F)F)c1.Cc1cc([S+](c2ccccc2)c2cc(C)c(O)c(C)c2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.FC(F)(F)Oc1ccc([S+](c2ccccc2)c2ccccc2)cc1.FC(F)(F)c1ccc([S+](c2ccccc2)c2ccccc2)cc1.Oc1cc([S+](c2ccccc2)c2ccccc2)ccc1F.Oc1ccc([S+](c2ccccc2)c2ccccc2)cc1F
InChIInChI=1S/C22H14F9S.2C22H22FOS.C22H22O2S.C20H16F3S.C20H18OS.C19H14F3OS.C19H14F3S.2C18H13FOS/c1-13-7-14(20(23,24)25)10-18(8-13)32(17-5-3-2-4-6-17)19-11-15(21(26,27)28)9-16(12-19)22(29,30)31;1-22(2,3)24-20-16-17(23)14-15-21(20)25(18-10-6-4-7-11-18)19-12-8-5-9-13-19;1-22(2,3)24-21-16-19(14-15-20(21)23)25(17-10-6-4-7-11-17)18-12-8-5-9-13-18;1-14-10-19(11-15(2)21(14)23)25(18-8-6-5-7-9-18)20-12-16(3)22(24)17(4)13-20;1-15-12-16(20(21,22)23)14-19(13-15)24(17-8-4-2-5-9-17)18-10-6-3-7-11-18;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;20-19(21,22)23-15-11-13-18(14-12-15)24(16-7-3-1-4-8-16)17-9-5-2-6-10-17;20-19(21,22)15-11-13-18(14-12-15)23(16-7-3-1-4-8-16)17-9-5-2-6-10-17;19-17-13-16(11-12-18(17)20)21(14-7-3-1-4-8-14)15-9-5-2-6-10-15;19-17-12-11-16(13-18(17)20)21(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h2-12H,1H3;2*4-16H,1-3H3;5-13H,1-4H3,(H-,23,24);2-14H,1H3;3-14H,1-2H3;1-14H;1-14H;2*1-13H/q3*+1;;+1;;2*+1;;/p+4
InChIKeyIZHVPTKRHGLCMR-UHFFFAOYSA-R
XLogP57.72
TPSA128.84 Ų
H-Bond Donors5
H-Bond Acceptors8
Rotatable Bonds33
Heavy Atoms242
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5003466.22
LogP ≤ 557.72
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium with MolForge

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Related Compounds

[3-[2-[3,5-Di(propan-2-yl)-4-(2,3,5,6-tetrafluoro-4-sulfophenoxy)phenyl]propyl]phenyl]-(3-hydroxyphenyl)-phenylsulfanium
CID 145622065
1-Fluoro-4-(4-fluorophenyl)sulfonylbenzene;4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]phenol;4-[2-[4-[4-[4-[4-[1,1,1,3,3,3-hexafluoro-2-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]propan-2-yl]phenoxy]phenyl]sulfonylphenoxy]-3-phenylphenyl]propan-2-yl]-1-methoxy-2-phenylbenzene;4-[2-(4-hydroxy-3-phenylphenyl)propan-2-yl]-2-phenylphenol
CID 157120689
2-[4-Bis(3,5-dimethylphenyl)sulfonio-2,6-dimethylphenoxy]-1,1-difluoropropane-1-sulfonate;2-[4-bis(4-hydroxyphenyl)sulfoniophenoxy]-1,1-difluoropropane-1-sulfonate;2-[4-bis[4-(2-methoxyethoxy)phenyl]sulfoniophenoxy]-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-[4-[(4-hydroxyphenyl)-phenylsulfonio]phenoxy]propane-1-sulfonate;1,1-difluoro-2-[4-[[4-(2-methoxyethoxy)phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate
CID 157187826
[3,5-Dimethyl-4-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethoxy]phenyl]-diphenylsulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-3-(1-methylcyclopentyl)oxyphenyl]-diphenylsulfanium;[4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]-diphenylsulfanium;10-[4-(trifluoromethyl)phenyl]phenoxathiin-10-ium;tris(4-fluorophenyl)sulfanium
CID 157272710
2-[4-Bis(4-tert-butylphenyl)sulfoniophenoxy]-1,1-difluoropropane-1-sulfonate;2-[4-bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-[4-[(4-hydroxyphenyl)-phenylsulfonio]phenoxy]propane-1-sulfonate;1,1-difluoro-2-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-1-sulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoropropane-1-sulfonate
CID 157275743
2-[4-Bis(4-tert-butylphenyl)sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-bis(3,5-dimethylphenyl)sulfonio-2,6-dimethylphenoxy]-1,1-difluoroethanesulfonate;2-[4-bis(4-hydroxyphenyl)sulfoniophenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-[4-[(4-tert-butylphenyl)-(4-methylphenyl)sulfonio]phenoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1-difluoro-2-[4-[(4-hydroxyphenyl)-phenylsulfonio]phenoxy]ethanesulfonate
CID 157565444
Bis(4-methylphenyl)-phenylsulfanium;(4-butoxyphenyl)-diphenylsulfanium;4-fluoro-2-methoxyperoxysulfanyl-1-methylbenzene;(4-hydroxyphenyl)-diphenylsulfanium;1-methoxyperoxysulfanyl-3,5-bis(trifluoromethyl)benzene;1-methoxyperoxysulfanyl-2-(trifluoromethyl)benzene;1-methoxyperoxysulfanyl-4-(trifluoromethyl)benzene;triphenylsulfanium
CID 157863833
Diphenyl(trifluoromethyl)sulfanium;(4-ethylphenyl)-diphenylsulfanium;(4-methoxy-3,5-dimethylphenyl)-phenyl-(trifluoromethyl)sulfanium;(4-methylphenyl)-diphenylsulfanium;triphenylsulfanium;tris(4-methylphenyl)sulfanium
CID 157877346
Difluoromethane;diphenyl-(2,4,6-trimethylphenyl)sulfanium;1-fluoro-4-methoxyperoxysulfanylbenzene;4-fluoro-1-methoxyperoxysulfanyl-2-methylbenzene;4-fluoro-2-methoxyperoxysulfanyl-1-methylbenzene;(4-hydroxyphenyl)-diphenylsulfanium;1-methoxyperoxysulfanyl-2-(trifluoromethyl)benzene;1-methoxyperoxysulfanyl-3-(trifluoromethyl)benzene;(4-methoxyphenyl)-diphenylsulfanium;1,2,3,4,5-pentafluoro-6-methoxyperoxysulfanylbenzene;tris(triphenylsulfanium)
CID 158223772
2-[4-Bis(3,5-dimethylphenyl)sulfonio-2,6-dimethylphenoxy]-1,1-difluoropropane-1-sulfonate;2-[4-bis(3,5-dimethylphenyl)sulfoniophenoxy]-1,1-difluoropropane-1-sulfonate;2-[4-bis(4-hydroxyphenyl)sulfoniophenoxy]-1,1-difluoropropane-1-sulfonate;1,1-difluoro-2-[4-[(4-hydroxyphenyl)-phenylsulfonio]phenoxy]propane-1-sulfonate
CID 158275618
Diphenyl-[2-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)phenyl]sulfanium;diphenyl-[3-(3,3,3-trifluoro-2-hydroxy-2-methylpropoxy)phenyl]sulfanium;diphenyl-[2-[3,3,3-trifluoro-2-(methoxymethoxy)-2-methylpropoxy]phenyl]sulfanium;diphenyl-[3-[3,3,3-trifluoro-2-(methoxymethoxy)-2-methylpropoxy]phenyl]sulfanium;[4-[4,4,4-trifluoro-3-(methoxymethoxy)-3-methylbutyl]phenyl]-[4-[3,3,3-trifluoro-2-(methoxymethoxy)-2-methylpropoxy]phenyl]-[4-[3,3,3-trifluoro-2-(methoxymethoxy)-2-(trifluoromethyl)propoxy]phenyl]sulfanium
CID 158389400
CID 158473064
CID 158473064

Frequently Asked Questions

What is the IUPAC name of bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium?
The IUPAC name of bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium (CID 158849909) is bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium.
What is the SMILES notation for bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium?
The canonical SMILES for bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium is CC(C)(C)Oc1cc(F)ccc1[S+](c1ccccc1)c1ccccc1.CC(C)(C)Oc1cc([S+](c2ccccc2)c2ccccc2)ccc1F.Cc1cc([S+](c2ccccc2)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc(C(F)(F)F)c1.Cc1cc([S+](c2ccccc2)c2cc(C)c(O)c(C)c2)cc(C)c1O.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C(F)(F)F)c1.Cc1cc([S+](c2ccccc2)c2ccccc2)cc(C)c1O.FC(F)(F)Oc1ccc([S+](c2ccccc2)c2ccccc2)cc1.FC(F)(F)c1ccc([S+](c2ccccc2)c2ccccc2)cc1.Oc1cc([S+](c2ccccc2)c2ccccc2)ccc1F.Oc1ccc([S+](c2ccccc2)c2ccccc2)cc1F.
What is the InChIKey of bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium?
The InChIKey is IZHVPTKRHGLCMR-UHFFFAOYSA-R. The full InChI is InChI=1S/C22H14F9S.2C22H22FOS.C22H22O2S.C20H16F3S.C20H18OS.C19H14F3OS.C19H14F3S.2C18H13FOS/c1-13-7-14(20(23,24)25)10-18(8-13)32(17-5-3-2-4-6-17)19-11-15(21(26,27)28)9-16(12-19)22(29,30)31;1-22(2,3)24-20-16-17(23)14-15-21(20)25(18-10-6-4-7-11-18)19-12-8-5-9-13-19;1-22(2,3)24-21-16-19(14-15-20(21)23)25(17-10-6-4-7-11-17)18-12-8-5-9-13-18;1-14-10-19(11-15(2)21(14)23)25(18-8-6-5-7-9-18)20-12-16(3)22(24)17(4)13-20;1-15-12-16(20(21,22)23)14-19(13-15)24(17-8-4-2-5-9-17)18-10-6-3-7-11-18;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;20-19(21,22)23-15-11-13-18(14-12-15)24(16-7-3-1-4-8-16)17-9-5-2-6-10-17;20-19(21,22)15-11-13-18(14-12-15)23(16-7-3-1-4-8-16)17-9-5-2-6-10-17;19-17-13-16(11-12-18(17)20)21(14-7-3-1-4-8-14)15-9-5-2-6-10-15;19-17-12-11-16(13-18(17)20)21(14-7-3-1-4-8-14)15-9-5-2-6-10-15/h2-12H,1H3;2*4-16H,1-3H3;5-13H,1-4H3,(H-,23,24);2-14H,1H3;3-14H,1-2H3;1-14H;1-14H;2*1-13H/q3*+1;;+1;;2*+1;;/p+4.
What are the key properties of bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium?
bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium has a molecular weight of 3466.22 g/mol, XLogP of 57.72, 33 rotatable bonds, 5 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(4-hydroxy-3,5-dimethylphenyl)-phenylsulfanium;[3,5-bis(trifluoromethyl)phenyl]-[3-methyl-5-(trifluoromethyl)phenyl]-phenylsulfanium;diphenyl-[4-(trifluoromethoxy)phenyl]sulfanium;diphenyl-[4-(trifluoromethyl)phenyl]sulfanium;(3-fluoro-4-hydroxyphenyl)-diphenylsulfanium;(4-fluoro-3-hydroxyphenyl)-diphenylsulfanium;[4-fluoro-2-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;[4-fluoro-3-[(2-methylpropan-2-yl)oxy]phenyl]-diphenylsulfanium;(4-hydroxy-3,5-dimethylphenyl)-diphenylsulfanium;[3-methyl-5-(trifluoromethyl)phenyl]-diphenylsulfanium is sourced from PubChem (CID 158849909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).