4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium)

C166H172F10O26S6 — CID 157239278

IUPAC4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium)
SMILESCCC(C)c1c(F)c(F)c(Oc2c(F)c(F)c(S(=O)(=O)[O-])c(F)c2F)c(F)c1F.CCC(C)c1ccc(O)c(C(=O)OC)c1.CCC(C)c1ccc(OCCOc2ccc(S(=O)(=O)[O-])cc2)c(C(=O)OC)c1.CCC(C)c1cccc2c(O)cccc12.CCC(C)c1cccc2c(OC(=O)CC(F)(F)S(=O)(=O)[O-])cccc12.CCC(C)c1cccc2c(OC(C)OC)cccc12.CCOC(C)Oc1ccc(C(C)CC)cc1C(=O)OC.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H24O7S.3C18H15S.C17H18F2O5S.C17H22O2.C16H10F8O4S.C16H24O4.C14H16O.C12H16O3/c1-4-14(2)15-5-10-19(18(13-15)20(21)25-3)27-12-11-26-16-6-8-17(9-7-16)28(22,23)24;3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-11(2)12-6-4-8-14-13(12)7-5-9-15(14)24-16(20)10-17(18,19)25(21,22)23;1-5-12(2)14-8-6-10-16-15(14)9-7-11-17(16)19-13(3)18-4;1-3-4(2)5-6(17)8(19)14(9(20)7(5)18)28-15-10(21)12(23)16(29(25,26)27)13(24)11(15)22;1-6-11(3)13-8-9-15(20-12(4)19-7-2)14(10-13)16(17)18-5;1-3-10(2)11-6-4-8-13-12(11)7-5-9-14(13)15;1-4-8(2)9-5-6-11(13)10(7-9)12(14)15-3/h5-10,13-14H,4,11-12H2,1-3H3,(H,22,23,24);3*1-15H;4-9,11H,3,10H2,1-2H3,(H,21,22,23);6-13H,5H2,1-4H3;4H,3H2,1-2H3,(H,25,26,27);8-12H,6-7H2,1-5H3;4-10,15H,3H2,1-2H3;5-8,13H,4H2,1-3H3/q;3*+1;;;;;;/p-3
InChIKeyAUZZPJKRMAGCKV-UHFFFAOYSA-K
MW2965.56 g/mol
LogP41.71
Rot. Bonds46

About 4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium)

4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium) (PubChem CID 157239278) has the molecular formula C166H172F10O26S6 and a molecular weight of 2965.56 g/mol. Its IUPAC name is 4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium).

Molecular Properties

Compound Name4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium)
PubChem CID157239278
Molecular FormulaC166H172F10O26S6
Molecular Weight2965.56 g/mol
Exact Mass2963.03
IUPAC Name4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium)
SMILESCCC(C)c1c(F)c(F)c(Oc2c(F)c(F)c(S(=O)(=O)[O-])c(F)c2F)c(F)c1F.CCC(C)c1ccc(O)c(C(=O)OC)c1.CCC(C)c1ccc(OCCOc2ccc(S(=O)(=O)[O-])cc2)c(C(=O)OC)c1.CCC(C)c1cccc2c(O)cccc12.CCC(C)c1cccc2c(OC(=O)CC(F)(F)S(=O)(=O)[O-])cccc12.CCC(C)c1cccc2c(OC(C)OC)cccc12.CCOC(C)Oc1ccc(C(C)CC)cc1C(=O)OC.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C20H24O7S.3C18H15S.C17H18F2O5S.C17H22O2.C16H10F8O4S.C16H24O4.C14H16O.C12H16O3/c1-4-14(2)15-5-10-19(18(13-15)20(21)25-3)27-12-11-26-16-6-8-17(9-7-16)28(22,23)24;3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-11(2)12-6-4-8-14-13(12)7-5-9-15(14)24-16(20)10-17(18,19)25(21,22)23;1-5-12(2)14-8-6-10-16-15(14)9-7-11-17(16)19-13(3)18-4;1-3-4(2)5-6(17)8(19)14(9(20)7(5)18)28-15-10(21)12(23)16(29(25,26)27)13(24)11(15)22;1-6-11(3)13-8-9-15(20-12(4)19-7-2)14(10-13)16(17)18-5;1-3-10(2)11-6-4-8-13-12(11)7-5-9-14(13)15;1-4-8(2)9-5-6-11(13)10(7-9)12(14)15-3/h5-10,13-14H,4,11-12H2,1-3H3,(H,22,23,24);3*1-15H;4-9,11H,3,10H2,1-2H3,(H,21,22,23);6-13H,5H2,1-4H3;4H,3H2,1-2H3,(H,25,26,27);8-12H,6-7H2,1-5H3;4-10,15H,3H2,1-2H3;5-8,13H,4H2,1-3H3/q;3*+1;;;;;;/p-3
InChIKeyAUZZPJKRMAGCKV-UHFFFAOYSA-K
XLogP41.71
TPSA381.87 Ų
H-Bond Donors2
H-Bond Acceptors26
Rotatable Bonds46
Heavy Atoms208
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002965.56
LogP ≤ 541.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1026

Computed Properties (RDKit)

Structural Alerts{'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'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': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze 4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium) 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

2-[4-(4-Diphenylsulfoniophenoxy)cyclohexanecarbonyl]oxy-1,1-difluoropropane-1-sulfonate;2-[5-(4-diphenylsulfoniophenoxy)naphthalene-1-carbonyl]oxy-1,1-difluoropropane-1-sulfonate
CID 157154254
4-[2-(4-Ethenyl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;3-(5-ethenylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-[2-(3-ethenylphenoxy)acetyl]benzenesulfonate;4-(3-ethenylphenoxy)benzenesulfonate;4-(4-ethenyl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate
CID 157383611
6-ethenylnaphthalen-2-ol;4-ethenylphenol;(4-ethenylphenyl) benzoate;1H-indene;(4-methyl-2-oxooxolan-3-yl) 2-methylprop-2-enoate;3-methylpentan-3-yl 2-methylprop-2-enoate;1,1,3,3,3-pentafluoro-2-prop-2-enoyloxypropane-1-sulfonate;triphenylsulfanium
CID 157758516
1-Butan-2-yl-4-(1-ethoxy-2,2-dimethylpropoxy)benzene;1-butan-2-yl-4-(1-ethoxy-2-methylpropoxy)benzene;bis(4-butan-2-ylphenol);bis(3-(4-butan-2-ylphenoxy)sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonate);(4-butan-2-ylphenyl) acetate;1-(4-cyclohexylphenyl)-2-methyl-2-(thiolan-1-ium-1-yl)propan-1-one;5-methoxy-1,3-dimethyl-2-[2-(4-methylphenyl)propan-2-yl]benzene
CID 157879408
4-(4-butan-2-yl-2-methoxycarbonylphenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;bis(4-butan-2-ylphenol);1-[2-(4-butan-2-ylphenoxy)-2-ethoxyethyl]adamantane;2-[(4-butan-2-ylphenoxy)methoxy]bicyclo[2.2.1]heptane;4-(4-butan-2-ylphenoxy)-2,3,5,6-tetrafluoro-N-(trifluoromethylsulfonyl)benzenesulfonimidate;(4-butan-2-ylphenyl) acetate;(3-hydroxyphenyl)-diphenylsulfanium;1-phenyl-2,3-dihydro-1-benzothiophen-1-ium
CID 158304741
1-Anthracen-2-ylethyl 2,2-dimethylbutanoate;4-butan-2-ylphenol;2-(2,2-dimethylbutanoyloxy)-1,1,3,3,3-pentafluoropropane-1-sulfonate;methane;[4-(4-methoxyphenyl)sulfonylsulfonylphenyl] 2,2-dimethylbutanoate;methyl 5-butan-2-yl-2-hydroxybenzoate;triphenylsulfanium
CID 159202589
Bis(3-(2,3-dimethylcyclobutyl)-1-methyl-5,6-di(propan-2-yl)cyclohexene);3,5-di(propan-2-yl)benzoic acid;4-[3,4-di(propan-2-yl)phenoxy]-1,2-di(propan-2-yl)benzene;5-[(3-formyloxy-4-propan-2-ylphenyl)methyl]-2-propan-2-ylbenzoic acid;4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxy-3-propan-2-ylphenyl)propan-2-yl]-2-propan-2-ylphenol;4-(4-hydroxy-3-propan-2-ylphenyl)-2-propan-2-ylphenol;1-propan-2-yl-4-[4-[2-[4-(4-propan-2-ylphenoxy)phenyl]propan-2-yl]phenoxy]benzene;bis(1-propan-2-yl-3-[4-[4-(3-propan-2-ylphenoxy)phenyl]sulfonylphenoxy]benzene);tris(5,6,7,8-tetra(propan-2-yl)bicyclo[2.2.2]oct-2-ene)
CID 159654568
3,4-dihydro-2H-chromen-2-yl 2-[(4-fluorophenyl)sulfonyloxymethyl]-2-methyl-3-oxobutanoate;1-(4-methoxyphenyl)ethyl 2-ethyl-2-[[3-methyl-5-(trifluoromethyl)phenyl]sulfonyloxymethyl]-3-oxobutanoate;naphthalen-1-yloxymethyl 3-cyclohexyl-2-methyl-2-[(4-methylphenyl)sulfonyloxymethyl]-3-oxopropanoate;naphthalen-1-yloxymethyl 2-methyl-2-[(4-methylphenyl)sulfonyloxymethyl]-3-oxo-3-phenylpropanoate;1-phenoxypropyl 3-(benzenesulfonyloxy)-2-methyl-2-methylsulfinylpropanoate
CID 159693203
4-(4-Butan-2-ylbenzoyl)-2,3,5-trifluoro-6-(trifluoromethyl)benzenesulfonate;1-butan-2-yl-3-(1-cyclohexyloxyethoxy)benzene;3-butan-2-ylphenol;(3-butan-2-ylphenyl) acetate;(4-methylphenyl)-diphenylsulfanium
CID 159913555
2-Butan-2-yl-6-(1,5-dicyclohexylpentan-2-yloxy)naphthalene;1-butan-2-yl-4-(2-methylbutan-2-yloxy)benzene;6-butan-2-ylnaphthalen-2-ol;2-[2-(6-butan-2-ylnaphthalen-2-yl)oxy-2-oxoethoxy]-1,1,3,3,3-pentafluoropropane-1-sulfonate;4-butan-2-ylphenol;(4-butan-2-ylphenyl) benzoate;5-(4-ethoxyphenyl)dibenzothiophen-5-ium
CID 160181329
1-[4-[4-(3-Tert-butylphenoxy)phenyl]sulfonylphenoxy]-3-propan-2-ylbenzene;1-(4-tert-butylphenoxy)-4-[2-[4-(4-propan-2-ylphenoxy)phenyl]propan-2-yl]benzene;3,5-di(propan-2-yl)benzoic acid;5-[(3-formyloxy-4-propan-2-ylphenyl)methyl]-2-propan-2-ylbenzoic acid;4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxy-3-propan-2-ylphenyl)propan-2-yl]-2-propan-2-ylphenol;4-(4-hydroxy-3-propan-2-ylphenyl)-2-propan-2-ylphenol
CID 160251182
2-(6-Ethenyl-3-hydroxynaphthalene-2-carbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;2-(1-ethenylnaphthalene-2-carbonyl)oxy-1,1,3,3,3-pentafluoropropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[1-(2-methylprop-2-enoyloxy)naphthalene-2-carbonyl]oxypropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[2-(2-methylprop-2-enoyloxy)naphthalene-1-carbonyl]oxypropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[3-(2-methylprop-2-enoyloxy)naphthalene-2-carbonyl]oxypropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-[6-(2-methylprop-2-enoyloxy)naphthalene-2-carbonyl]oxypropane-1-sulfonate;1,1,3,3,3-pentafluoro-2-(3-prop-2-enoyloxynaphthalene-2-carbonyl)oxypropane-1-sulfonate
CID 160399714

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium)?
The IUPAC name of 4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium) (CID 157239278) is 4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium).
What is the SMILES notation for 4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium)?
The canonical SMILES for 4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium) is CCC(C)c1c(F)c(F)c(Oc2c(F)c(F)c(S(=O)(=O)[O-])c(F)c2F)c(F)c1F.CCC(C)c1ccc(O)c(C(=O)OC)c1.CCC(C)c1ccc(OCCOc2ccc(S(=O)(=O)[O-])cc2)c(C(=O)OC)c1.CCC(C)c1cccc2c(O)cccc12.CCC(C)c1cccc2c(OC(=O)CC(F)(F)S(=O)(=O)[O-])cccc12.CCC(C)c1cccc2c(OC(C)OC)cccc12.CCOC(C)Oc1ccc(C(C)CC)cc1C(=O)OC.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.c1ccc([S+](c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium)?
The InChIKey is AUZZPJKRMAGCKV-UHFFFAOYSA-K. The full InChI is InChI=1S/C20H24O7S.3C18H15S.C17H18F2O5S.C17H22O2.C16H10F8O4S.C16H24O4.C14H16O.C12H16O3/c1-4-14(2)15-5-10-19(18(13-15)20(21)25-3)27-12-11-26-16-6-8-17(9-7-16)28(22,23)24;3*1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;1-3-11(2)12-6-4-8-14-13(12)7-5-9-15(14)24-16(20)10-17(18,19)25(21,22)23;1-5-12(2)14-8-6-10-16-15(14)9-7-11-17(16)19-13(3)18-4;1-3-4(2)5-6(17)8(19)14(9(20)7(5)18)28-15-10(21)12(23)16(29(25,26)27)13(24)11(15)22;1-6-11(3)13-8-9-15(20-12(4)19-7-2)14(10-13)16(17)18-5;1-3-10(2)11-6-4-8-13-12(11)7-5-9-14(13)15;1-4-8(2)9-5-6-11(13)10(7-9)12(14)15-3/h5-10,13-14H,4,11-12H2,1-3H3,(H,22,23,24);3*1-15H;4-9,11H,3,10H2,1-2H3,(H,21,22,23);6-13H,5H2,1-4H3;4H,3H2,1-2H3,(H,25,26,27);8-12H,6-7H2,1-5H3;4-10,15H,3H2,1-2H3;5-8,13H,4H2,1-3H3/q;3*+1;;;;;;/p-3.
What are the key properties of 4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium)?
4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium) has a molecular weight of 2965.56 g/mol, XLogP of 41.71, 46 rotatable bonds, 2 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-butan-2-yl-2-methoxycarbonylphenoxy)ethoxy]benzenesulfonate;1-butan-2-yl-5-(1-methoxyethoxy)naphthalene;5-butan-2-ylnaphthalen-1-ol;3-(5-butan-2-ylnaphthalen-1-yl)oxy-1,1-difluoro-3-oxopropane-1-sulfonate;4-(4-butan-2-yl-2,3,5,6-tetrafluorophenoxy)-2,3,5,6-tetrafluorobenzenesulfonate;methyl 5-butan-2-yl-2-(1-ethoxyethoxy)benzoate;methyl 5-butan-2-yl-2-hydroxybenzoate;tris(triphenylsulfanium) is sourced from PubChem (CID 157239278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).