anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate

C176H191AsClF12O22PS18+2 — CID 162082054

IUPACanthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate
SMILESC.C.C.CCCCCCCCS(=O)(=O)[O-].CCCCOC(=O)c1ccccc1S(=O)(=O)[O-].CCOc1ccc([SH+]c2ccc(C)cc2)cc1.COc1c2ccccc2c(OC)c2cc(S(=O)(=O)[O-])ccc12.C[S+](C)CC(=O)c1ccccc1.C[S+](CCl)c1ccccc1.Cc1cc(C)c(S(=O)(=O)[O-])c(C)c1.F[As](F)(F)(F)F.F[P-](F)(F)(F)(F)F.O=C(C[S+]1CCCC1)c1ccc2ccccc2c1.O=S(=O)([O-])c1cccc2cc3ccccc3cc12.Sc1ccc([SH+]c2ccccc2)cc1.Sc1ccc([SH+]c2ccccc2)cc1.[F-].[SH2+]c1ccccc1.c1ccc(Sc2ccc([SH+]c3ccccc3)cc2)cc1.c1ccc(Sc2ccc([SH+]c3ccccc3)cc2)cc1
InChIInChI=1S/2C18H14S2.C16H14O5S.C16H17OS.C15H16OS.C14H10O3S.2C12H10S2.C11H14O5S.C10H13OS.C9H12O3S.C8H10ClS.C8H18O3S.C6H6S.3CH4.AsF5.F6P.FH/c2*1-3-7-15(8-4-1)19-17-11-13-18(14-12-17)20-16-9-5-2-6-10-16;1-20-15-11-5-3-4-6-12(11)16(21-2)14-9-10(22(17,18)19)7-8-13(14)15;17-16(12-18-9-3-4-10-18)15-8-7-13-5-1-2-6-14(13)11-15;1-3-16-13-6-10-15(11-7-13)17-14-8-4-12(2)5-9-14;15-18(16,17)14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)14;2*13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11;1-2-3-8-16-11(12)9-6-4-5-7-10(9)17(13,14)15;1-12(2)8-10(11)9-6-4-3-5-7-9;1-6-4-7(2)9(8(3)5-6)13(10,11)12;1-10(7-9)8-5-3-2-4-6-8;1-2-3-4-5-6-7-8-12(9,10)11;7-6-4-2-1-3-5-6;;;;2-1(3,4,5)6;1-7(2,3,4,5)6;/h2*1-14H;3-9H,1-2H3,(H,17,18,19);1-2,5-8,11H,3-4,9-10,12H2;4-11H,3H2,1-2H3;1-9H,(H,15,16,17);2*1-9,13H;4-7H,2-3,8H2,1H3,(H,13,14,15);3-7H,8H2,1-2H3;4-5H,1-3H3,(H,10,11,12);2-6H,7H2,1H3;2-8H2,1H3,(H,9,10,11);1-5,7H;3*1H4;;;1H/q;;;+1;;;;;;+1;;+1;;;;;;;-1;
InChIKeyDSWHKTQSAFPUSL-UHFFFAOYSA-N
MW3604.97 g/mol
LogP43.70
Rot. Bonds41

About anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate

anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate (PubChem CID 162082054) has the molecular formula C176H191AsClF12O22PS18+2 and a molecular weight of 3604.97 g/mol. Its IUPAC name is anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate.

Molecular Properties

Compound Nameanthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate
PubChem CID162082054
Molecular FormulaC176H191AsClF12O22PS18+2
Molecular Weight3604.97 g/mol
Exact Mass3600.72
IUPAC Nameanthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate
SMILESC.C.C.CCCCCCCCS(=O)(=O)[O-].CCCCOC(=O)c1ccccc1S(=O)(=O)[O-].CCOc1ccc([SH+]c2ccc(C)cc2)cc1.COc1c2ccccc2c(OC)c2cc(S(=O)(=O)[O-])ccc12.C[S+](C)CC(=O)c1ccccc1.C[S+](CCl)c1ccccc1.Cc1cc(C)c(S(=O)(=O)[O-])c(C)c1.F[As](F)(F)(F)F.F[P-](F)(F)(F)(F)F.O=C(C[S+]1CCCC1)c1ccc2ccccc2c1.O=S(=O)([O-])c1cccc2cc3ccccc3cc12.Sc1ccc([SH+]c2ccccc2)cc1.Sc1ccc([SH+]c2ccccc2)cc1.[F-].[SH2+]c1ccccc1.c1ccc(Sc2ccc([SH+]c3ccccc3)cc2)cc1.c1ccc(Sc2ccc([SH+]c3ccccc3)cc2)cc1
InChIInChI=1S/2C18H14S2.C16H14O5S.C16H17OS.C15H16OS.C14H10O3S.2C12H10S2.C11H14O5S.C10H13OS.C9H12O3S.C8H10ClS.C8H18O3S.C6H6S.3CH4.AsF5.F6P.FH/c2*1-3-7-15(8-4-1)19-17-11-13-18(14-12-17)20-16-9-5-2-6-10-16;1-20-15-11-5-3-4-6-12(11)16(21-2)14-9-10(22(17,18)19)7-8-13(14)15;17-16(12-18-9-3-4-10-18)15-8-7-13-5-1-2-6-14(13)11-15;1-3-16-13-6-10-15(11-7-13)17-14-8-4-12(2)5-9-14;15-18(16,17)14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)14;2*13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11;1-2-3-8-16-11(12)9-6-4-5-7-10(9)17(13,14)15;1-12(2)8-10(11)9-6-4-3-5-7-9;1-6-4-7(2)9(8(3)5-6)13(10,11)12;1-10(7-9)8-5-3-2-4-6-8;1-2-3-4-5-6-7-8-12(9,10)11;7-6-4-2-1-3-5-6;;;;2-1(3,4,5)6;1-7(2,3,4,5)6;/h2*1-14H;3-9H,1-2H3,(H,17,18,19);1-2,5-8,11H,3-4,9-10,12H2;4-11H,3H2,1-2H3;1-9H,(H,15,16,17);2*1-9,13H;4-7H,2-3,8H2,1H3,(H,13,14,15);3-7H,8H2,1-2H3;4-5H,1-3H3,(H,10,11,12);2-6H,7H2,1H3;2-8H2,1H3,(H,9,10,11);1-5,7H;3*1H4;;;1H/q;;;+1;;;;;;+1;;+1;;;;;;;-1;
InChIKeyDSWHKTQSAFPUSL-UHFFFAOYSA-N
XLogP43.70
TPSA374.13 Ų
H-Bond Donors2
H-Bond Acceptors26
Rotatable Bonds41
Heavy Atoms231
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003604.97
LogP ≤ 543.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}, {'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

Analyze anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate with MolForge

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Related Compounds

[1-(4-Butoxynaphthalen-1-yl)thiolan-1-yl] 1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctane-1-sulfonate;[1-(2-naphthalen-2-yl-2-oxoethyl)thiolan-1-yl] trifluoromethanesulfonate
CID 139973418
Benzenesulfonate;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;fluoroform;octane-1-sulfonate;2,3,4,5,6-pentafluorobenzenesulfonate;pentafluoro-lambda5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite
CID 157172981
Benzenesulfonate;bis(4-benzylbenzenethiol);1-benzyl-4-butoxybenzene;bis(1-benzyl-4-phenylsulfanylbenzene);butyl 2-oxidoperoxysulfanylbenzoate;1-chloropropan-2-ylbenzene;2-cyclohexyl-1-phenylethanone;2-cyclopentyl-1-naphthalen-2-ylethanone;bis(2-cyclopentyl-1-phenylethanone);9,10-dimethoxyanthracene-2-sulfonate;1-ethoxy-4-[(4-methylphenyl)methyl]benzene;4-ethyl-2,6-dimethylbenzenesulfonate;fluoroform;3-methyl-1-phenylbutan-1-one;octane-1-sulfonate;1-oxidoperoxysulfanylanthracene;bis(2,3,4,5,6-pentafluorobenzenesulfonate);tris(pentafluoro-lambda5-phosphane);toluene;bis(tridecane);trifluoromethanesulfonate;trifluoride;sulfite
CID 157181140
2-(Adamantane-1-carbonyloxy)-1,1-difluoroethanesulfonate;2-(1-adamantylmethoxy)-1,1-difluoro-2-oxoethanesulfonate;1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;1-(4-cyclohexylphenyl)-3,3-dimethyl-2-(thiolan-1-ium-1-yl)butan-1-one;[difluoro-[2,4,6-tri(propan-2-yl)phenoxy]sulfonylmethyl]sulfonyl-(trifluoromethylsulfonyl)azanide;bis(2,3,5,6-tetrafluoro-4-(2,4,6-tricyclohexylphenoxy)benzenesulfonate);2,3,5,6-tetrafluoro-4-[2,4,6-tri(propan-2-yl)phenoxy]benzenesulfonate;bis(2,4,6-tricyclohexylbenzenesulfonate);tris(triphenylsulfanium);2,4,6-tri(propan-2-yl)benzenesulfonate;tris(tris(4-fluorophenyl)sulfanium);tris(3-methoxyphenyl)sulfanium
CID 157897705
2-(1-Adamantylmethoxy)-1,1-difluoro-2-oxoethanesulfonate;1-[4-(cyclohexylmethoxy)naphthalen-1-yl]thiolan-1-ium;1-(4-cyclohexylphenyl)-3,3-dimethyl-2-(thiolan-1-ium-1-yl)butan-1-one;bis(2,4,6-tricyclohexylbenzenesulfonate);triphenylsulfanium
CID 157983872
2-(Adamantane-1-carbonyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(1-adamantylmethoxy)-1,1-difluoro-2-oxoethanesulfonate;1-(4-butoxynaphthalen-1-yl)thiolan-1-ium;1,1-difluoro-2-[2-(5-hydroxynaphthalen-1-yl)oxyethoxy]-2-oxoethanesulfonate;1,1,3,3,3-pentafluoro-2-(naphthalene-2-carbonyloxy)propane-1-sulfonate;1-phenyl-2-(thiolan-1-ium-1-yl)ethanone;bis(triphenylsulfanium)
CID 158503286
Benzenesulfonate;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;fluoroform;octane-1-sulfonate;pentafluoro-lambda5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite
CID 158992345
Chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;fluoroform;1-oxidoperoxysulfanylanthracene;2,3,4,5,6-pentafluorobenzenesulfonate;phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;sulfite
CID 159200078
Benzenesulfonate;(4-butoxyphenyl)-phenylsulfanium;butyl 2-oxidoperoxysulfanylbenzoate;fluoroform;hexa-1,3,5-triyne;molecular hydrogen;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;pentafluoro-lambda5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenyl-(4-sulfanylphenyl)sulfanium;1-phenyl-2-(thian-1-ium-1-yl)ethanone;bis(tridecane);trifluoromethanesulfonate;fluoride;disulfite
CID 159434652
Methane;bis(5-[4-(naphthalen-1-yloxymethyl)phenyl]-2-(naphthalen-2-ylsulfonylmethyl)benzoic acid);2-(naphthalen-2-ylsulfonylmethyl)-5-(2-phenylethylsulfanyl)-4-propan-2-ylbenzoic acid;2-(naphthalen-2-ylsulfonylmethyl)-4-propan-2-yl-5-[4-[2-[3-(trifluoromethyl)phenyl]ethyl]phenyl]benzoic acid
CID 159904161
2-(Benzenesulfonyl)-1,4-dimethylbenzene;[4-[4-[difluoro-[4-[4-(4-methylbenzoyl)phenoxy]phenyl]methyl]phenoxy]phenyl]-(4-methylphenyl)methanone;1-[4-[4-[difluoro-[4-[4-(4-methylphenyl)sulfonylphenoxy]phenyl]methyl]phenoxy]phenyl]sulfonyl-4-methylbenzene;1,4-dimethyl-2-(4-phenoxyphenyl)sulfonylbenzene;(2,5-dimethylphenyl)-(4-naphthalen-1-yloxyphenyl)methanone;(2,5-dimethylphenyl)-(4-naphthalen-2-yloxyphenyl)methanone;(2,5-dimethylphenyl)-[4-(4-phenoxyphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenoxyphenyl)methanone;(2,5-dimethylphenyl)-phenylmethanone;(2,5-dimethylphenyl)-[4-(4-phenylphenoxy)phenyl]methanone;(2,5-dimethylphenyl)-(4-phenylphenyl)methanone;1,4-dimethyl-2-(4-phenylphenyl)sulfonylbenzene
CID 159947826
(1,1-Difluoro-1-methoxysulfonylpropan-2-yl) 4-prop-1-en-2-ylnaphthalene-1-carboxylate;(1,1-difluoro-1-methoxysulfonylpropan-2-yl) 5-prop-1-en-2-ylnaphthalene-1-carboxylate;(4-methoxysulfonylphenyl) 2-methylprop-2-enoate;methyl 2-ethenylbenzenesulfonate;methyl 3-ethenylbenzenesulfonate;methyl 4-ethenylbenzenesulfonate;(1,1,1,3,3-pentafluoro-3-methoxysulfonylpropan-2-yl) 6-prop-1-en-2-ylnaphthalene-2-carboxylate;(1,1,1,3,3-pentafluoro-3-methoxysulfonylpropan-2-yl) 7-prop-1-en-2-ylnaphthalene-1-carboxylate;(1,1,1-trifluoro-3-methoxysulfonylpropan-2-yl) 5-prop-1-en-2-ylnaphthalene-2-carboxylate;(1,1,1-trifluoro-3-methoxysulfonylpropan-2-yl) 7-prop-1-en-2-ylnaphthalene-2-carboxylate
CID 160342461

Frequently Asked Questions

What is the IUPAC name of anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate?
The IUPAC name of anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate (CID 162082054) is anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate.
What is the SMILES notation for anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate?
The canonical SMILES for anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate is C.C.C.CCCCCCCCS(=O)(=O)[O-].CCCCOC(=O)c1ccccc1S(=O)(=O)[O-].CCOc1ccc([SH+]c2ccc(C)cc2)cc1.COc1c2ccccc2c(OC)c2cc(S(=O)(=O)[O-])ccc12.C[S+](C)CC(=O)c1ccccc1.C[S+](CCl)c1ccccc1.Cc1cc(C)c(S(=O)(=O)[O-])c(C)c1.F[As](F)(F)(F)F.F[P-](F)(F)(F)(F)F.O=C(C[S+]1CCCC1)c1ccc2ccccc2c1.O=S(=O)([O-])c1cccc2cc3ccccc3cc12.Sc1ccc([SH+]c2ccccc2)cc1.Sc1ccc([SH+]c2ccccc2)cc1.[F-].[SH2+]c1ccccc1.c1ccc(Sc2ccc([SH+]c3ccccc3)cc2)cc1.c1ccc(Sc2ccc([SH+]c3ccccc3)cc2)cc1.
What is the InChIKey of anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate?
The InChIKey is DSWHKTQSAFPUSL-UHFFFAOYSA-N. The full InChI is InChI=1S/2C18H14S2.C16H14O5S.C16H17OS.C15H16OS.C14H10O3S.2C12H10S2.C11H14O5S.C10H13OS.C9H12O3S.C8H10ClS.C8H18O3S.C6H6S.3CH4.AsF5.F6P.FH/c2*1-3-7-15(8-4-1)19-17-11-13-18(14-12-17)20-16-9-5-2-6-10-16;1-20-15-11-5-3-4-6-12(11)16(21-2)14-9-10(22(17,18)19)7-8-13(14)15;17-16(12-18-9-3-4-10-18)15-8-7-13-5-1-2-6-14(13)11-15;1-3-16-13-6-10-15(11-7-13)17-14-8-4-12(2)5-9-14;15-18(16,17)14-7-3-6-12-8-10-4-1-2-5-11(10)9-13(12)14;2*13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11;1-2-3-8-16-11(12)9-6-4-5-7-10(9)17(13,14)15;1-12(2)8-10(11)9-6-4-3-5-7-9;1-6-4-7(2)9(8(3)5-6)13(10,11)12;1-10(7-9)8-5-3-2-4-6-8;1-2-3-4-5-6-7-8-12(9,10)11;7-6-4-2-1-3-5-6;;;;2-1(3,4,5)6;1-7(2,3,4,5)6;/h2*1-14H;3-9H,1-2H3,(H,17,18,19);1-2,5-8,11H,3-4,9-10,12H2;4-11H,3H2,1-2H3;1-9H,(H,15,16,17);2*1-9,13H;4-7H,2-3,8H2,1H3,(H,13,14,15);3-7H,8H2,1-2H3;4-5H,1-3H3,(H,10,11,12);2-6H,7H2,1H3;2-8H2,1H3,(H,9,10,11);1-5,7H;3*1H4;;;1H/q;;;+1;;;;;;+1;;+1;;;;;;;-1;.
What are the key properties of anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate?
anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate has a molecular weight of 3604.97 g/mol, XLogP of 43.70, 41 rotatable bonds, 2 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for anthracene-1-sulfonate;2-butoxycarbonylbenzenesulfonate;chloromethyl-methyl-phenylsulfanium;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;methane;1-naphthalen-2-yl-2-(thiolan-1-ium-1-yl)ethanone;octane-1-sulfonate;pentafluoro-λ5-arsane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);2,4,6-trimethylbenzenesulfonate;fluoride;hexafluorophosphate is sourced from PubChem (CID 162082054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).