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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite

C151H164F17O25PS18-2 — CID 157172981

IUPACbenzenesulfonate;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;fluoroform;octane-1-sulfonate;2,3,4,5,6-pentafluorobenzenesulfonate;pentafluoro-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite
SMILESCCCCCCCCCCCCC.CCCCCCCCS(=O)(=O)[O-].CCOc1ccc([SH+]c2ccc(C)cc2)cc1.COc1c2ccccc2c(OC)c2cc(S(=O)(=O)[O-])ccc12.C[S+](C)CC(=O)c1ccccc1.Cc1cc(C)c(S(=O)(=O)[O-])c(C)c1.FC(F)F.FP(F)(F)(F)F.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])c1c(F)c(F)c(F)c(F)c1F.O=S(=O)([O-])c1ccccc1.O=S([O-])[O-].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.C15H16OS.C13H28.2C12H10S2.C10H13OS.C9H12O3S.C8H18O3S.C6HF5O3S.C6H6O3S.C6H6S.CHF3O3S.CHF3.F5P.FH.H2O3S/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;1-3-16-13-6-10-15(11-7-13)17-14-8-4-12(2)5-9-14;1-3-5-7-9-11-13-12-10-8-6-4-2;2*13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11;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;1-2-3-4-5-6-7-8-12(9,10)11;7-1-2(8)4(10)6(15(12,13)14)5(11)3(1)9;7-10(8,9)6-4-2-1-3-5-6;7-6-4-2-1-3-5-6;2-1(3,4)8(5,6)7;2-1(3)4;1-6(2,3,4)5;;1-4(2)3/h2*1-14H;3-9H,1-2H3,(H,17,18,19);4-11H,3H2,1-2H3;3-13H2,1-2H3;2*1-9,13H;3-7H,8H2,1-2H3;4-5H,1-3H3,(H,10,11,12);2-8H2,1H3,(H,9,10,11);(H,12,13,14);1-5H,(H,7,8,9);1-5,7H;(H,5,6,7);1H;;1H;(H2,1,2,3)/q;;;;;;;+1;;;;;;;;;;/p-3
InChIKeyHRLPXWXPKQDEFU-UHFFFAOYSA-K
MW3310.09 g/mol
LogP36.70
Rot. Bonds42

About 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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite

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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite (PubChem CID 157172981) has the molecular formula C151H164F17O25PS18-2 and a molecular weight of 3310.09 g/mol. Its IUPAC name is 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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite.

Molecular Properties

Compound Namebenzenesulfonate;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;fluoroform;octane-1-sulfonate;2,3,4,5,6-pentafluorobenzenesulfonate;pentafluoro-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite
PubChem CID157172981
Molecular FormulaC151H164F17O25PS18-2
Molecular Weight3310.09 g/mol
Exact Mass3306.60
IUPAC Namebenzenesulfonate;9,10-dimethoxyanthracene-2-sulfonate;dimethyl(phenacyl)sulfanium;(4-ethoxyphenyl)-(4-methylphenyl)sulfanium;fluoroform;octane-1-sulfonate;2,3,4,5,6-pentafluorobenzenesulfonate;pentafluoro-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite
SMILESCCCCCCCCCCCCC.CCCCCCCCS(=O)(=O)[O-].CCOc1ccc([SH+]c2ccc(C)cc2)cc1.COc1c2ccccc2c(OC)c2cc(S(=O)(=O)[O-])ccc12.C[S+](C)CC(=O)c1ccccc1.Cc1cc(C)c(S(=O)(=O)[O-])c(C)c1.FC(F)F.FP(F)(F)(F)F.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])c1c(F)c(F)c(F)c(F)c1F.O=S(=O)([O-])c1ccccc1.O=S([O-])[O-].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.C15H16OS.C13H28.2C12H10S2.C10H13OS.C9H12O3S.C8H18O3S.C6HF5O3S.C6H6O3S.C6H6S.CHF3O3S.CHF3.F5P.FH.H2O3S/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;1-3-16-13-6-10-15(11-7-13)17-14-8-4-12(2)5-9-14;1-3-5-7-9-11-13-12-10-8-6-4-2;2*13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11;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;1-2-3-4-5-6-7-8-12(9,10)11;7-1-2(8)4(10)6(15(12,13)14)5(11)3(1)9;7-10(8,9)6-4-2-1-3-5-6;7-6-4-2-1-3-5-6;2-1(3,4)8(5,6)7;2-1(3)4;1-6(2,3,4)5;;1-4(2)3/h2*1-14H;3-9H,1-2H3,(H,17,18,19);4-11H,3H2,1-2H3;3-13H2,1-2H3;2*1-9,13H;3-7H,8H2,1-2H3;4-5H,1-3H3,(H,10,11,12);2-8H2,1H3,(H,9,10,11);(H,12,13,14);1-5H,(H,7,8,9);1-5,7H;(H,5,6,7);1H;;1H;(H2,1,2,3)/q;;;;;;;+1;;;;;;;;;;/p-3
InChIKeyHRLPXWXPKQDEFU-UHFFFAOYSA-K
XLogP36.70
TPSA451.15 Ų
H-Bond Donors2
H-Bond Acceptors29
Rotatable Bonds42
Heavy Atoms212
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003310.09
LogP ≤ 536.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1029

Computed Properties (RDKit)

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

Analyze 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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[5-(3-Methoxysulfonyl-4-methylbenzoyl)-2-[4-[4-[2,3,5,6-tetrafluoro-4-(2,3,5,6-tetrafluoro-4-methylphenyl)sulfonylphenoxy]phenyl]sulfonylphenoxy]phenyl]methanesulfonic acid
CID 88292872
[2-[4-[3,5-Dimethyl-4-[2,3,5,6-tetrafluoro-4-(2,3,5,6-tetrafluoro-4-methylphenyl)sulfonylphenoxy]phenyl]sulfonyl-2,6-dimethylphenoxy]-5-(3-methoxysulfonyl-4-methylbenzoyl)phenyl]methanesulfonic acid
CID 88292882
[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
Ethane;1-[4-[4-[1,1,1,3,3,3-hexafluoro-2-(4-phenylmethoxyphenyl)propan-2-yl]phenoxy]phenyl]sulfonyl-4-methylbenzene;methanesulfonic acid;1-methyl-4-[4-[4-(4-phenylmethoxyphenyl)phenoxy]phenyl]sulfonylbenzene;1-methyl-4-[4-[4-[2-(4-phenylmethoxyphenyl)propan-2-yl]phenoxy]phenyl]sulfonylbenzene;(4-methylphenyl)-[4-(6-phenylmethoxynaphthalen-2-yl)oxyphenyl]methanone;1-[4-(4-methylphenyl)sulfonylphenoxy]-4-phenylmethoxynaphthalene;1-[4-(4-methylphenyl)sulfonylphenoxy]-5-phenylmethoxynaphthalene;2-[4-(4-methylphenyl)sulfonylphenoxy]-6-phenylmethoxynaphthalene;2-[4-(4-methylphenyl)sulfonylphenoxy]-7-phenylmethoxynaphthalene
CID 157177279
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
4-(4-Butoxy-3,5-dimethylphenyl)-1,4-oxathian-4-ium;4-(4-butoxynaphthalen-1-yl)-1,4-oxathian-4-ium;4-(4-tert-butylphenyl)-1,4-oxathian-4-ium;4-[4-(cyclohexylmethoxy)naphthalen-1-yl]-1,4-oxathian-4-ium;3,3-dimethyl-2-(1,4-oxathian-4-ium-4-yl)-1-phenylbutan-1-one;4-[4-(2-methoxyethoxy)naphthalen-1-yl]-1,4-oxathian-4-ium;1-naphthalen-2-yl-2-(1,4-oxathian-4-ium-4-yl)ethanone;2-(1,4-oxathian-4-ium-4-yl)-1-phenylethanone;4-[4-(2,2,2-trifluoroethoxy)naphthalen-1-yl]-1,4-oxathian-4-ium
CID 157260055
Bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenoxy)phenyl]phenoxy]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)-1,2-dimethylbenzene;4-[2-(3,4-dimethylphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,2-dimethylbenzene;4-[4-(3,4-dimethylphenyl)phenyl]-1,2-dimethylbenzene;4-[4-[4-(3,4-dimethylphenyl)phenyl]phenyl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;3,4,9,10-tetramethyl-3a,12c-dihydroperylene;1,2,4,5-tetramethylbenzene;1,2,5,6-tetramethylnaphthalene;2,3,6,7-tetramethylnaphthalene
CID 157335764
CID 157499781
CID 157499781
1,1'-Biphenyl;bis(3,4-dimethylphenyl)methanone;4-(3,4-dimethylphenoxy)-1,2-dimethylbenzene;1-(3,4-dimethylphenoxy)-4-[2-[4-(3,4-dimethylphenoxy)-3-methylphenyl]propan-2-yl]-2-methylbenzene;4-[4-(3,4-dimethylphenoxy)phenoxy]-1,2-dimethylbenzene;4-[2-(3,4-dimethylphenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]-1,2-dimethylbenzene;4-[2-(3,4-dimethylphenyl)propan-2-yl]-1,2-dimethylbenzene;4-(3,4-dimethylphenyl)sulfonyl-1,2-dimethylbenzene;ethane;methane;naphthalene
CID 157548118
2-(Adamantane-1-carbonyloxy)-3,3,3-trifluoro-2-(trifluoromethyl)propane-1-sulfonate;4-tert-butylbenzoate;(4-tert-butylphenyl)-diphenylsulfanium;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;10-phenylphenoxathiin-10-ium;tris(triphenylsulfanium);bis(2,4,6-tri(propan-2-yl)benzenesulfonate)
CID 157550170
3-[4-Bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1,1,2-tetrafluoropropane-2-sulfonate;3-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1,1,2-tetrafluoropropane-2-sulfonate;3-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1,1-trifluoro-2-methylpropane-2-sulfonate;3-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1,1-trifluoro-2-methylpropane-2-sulfonate;1,1,1,2-tetrafluoro-3-[4-[[4-[(2-methylpropan-2-yl)oxy]phenyl]-phenylsulfonio]phenoxy]propane-2-sulfonate
CID 157569534
2-[4-Bis[4-[(2-methylpropan-2-yl)oxy]phenyl]sulfoniophenoxy]-1,1-difluoroethanesulfonate;2-(4-diphenylsulfonio-2,6-dimethylphenoxy)-1,1-difluoroethanesulfonate;2-[4-(4-diphenylsulfoniophenoxy)benzoyl]oxy-1,1-difluoroethanesulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoroethanesulfonate;2-[6-(4-diphenylsulfoniophenoxy)naphthalene-2-carbonyl]oxy-1,1-difluoroethanesulfonate
CID 157649411

Frequently Asked Questions

What is the IUPAC name of 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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite?
The IUPAC name of 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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite (CID 157172981) is 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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite.
What is the SMILES notation for 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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite?
The canonical SMILES for 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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite is CCCCCCCCCCCCC.CCCCCCCCS(=O)(=O)[O-].CCOc1ccc([SH+]c2ccc(C)cc2)cc1.COc1c2ccccc2c(OC)c2cc(S(=O)(=O)[O-])ccc12.C[S+](C)CC(=O)c1ccccc1.Cc1cc(C)c(S(=O)(=O)[O-])c(C)c1.FC(F)F.FP(F)(F)(F)F.O=S(=O)([O-])C(F)(F)F.O=S(=O)([O-])c1c(F)c(F)c(F)c(F)c1F.O=S(=O)([O-])c1ccccc1.O=S([O-])[O-].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 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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite?
The InChIKey is HRLPXWXPKQDEFU-UHFFFAOYSA-K. The full InChI is InChI=1S/2C18H14S2.C16H14O5S.C15H16OS.C13H28.2C12H10S2.C10H13OS.C9H12O3S.C8H18O3S.C6HF5O3S.C6H6O3S.C6H6S.CHF3O3S.CHF3.F5P.FH.H2O3S/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;1-3-16-13-6-10-15(11-7-13)17-14-8-4-12(2)5-9-14;1-3-5-7-9-11-13-12-10-8-6-4-2;2*13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11;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;1-2-3-4-5-6-7-8-12(9,10)11;7-1-2(8)4(10)6(15(12,13)14)5(11)3(1)9;7-10(8,9)6-4-2-1-3-5-6;7-6-4-2-1-3-5-6;2-1(3,4)8(5,6)7;2-1(3)4;1-6(2,3,4)5;;1-4(2)3/h2*1-14H;3-9H,1-2H3,(H,17,18,19);4-11H,3H2,1-2H3;3-13H2,1-2H3;2*1-9,13H;3-7H,8H2,1-2H3;4-5H,1-3H3,(H,10,11,12);2-8H2,1H3,(H,9,10,11);(H,12,13,14);1-5H,(H,7,8,9);1-5,7H;(H,5,6,7);1H;;1H;(H2,1,2,3)/q;;;;;;;+1;;;;;;;;;;/p-3.
What are the key properties of 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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite?
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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite has a molecular weight of 3310.09 g/mol, XLogP of 36.70, 42 rotatable bonds, 2 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 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-λ5-phosphane;bis(phenyl-(4-phenylsulfanylphenyl)sulfanium);phenylsulfanium;bis(phenyl-(4-sulfanylphenyl)sulfanium);tridecane;trifluoromethanesulfonate;2,4,6-trimethylbenzenesulfonate;fluoride;sulfite is sourced from PubChem (CID 157172981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).