2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate

C179H246O35S11-6 — CID 162129455

IUPAC2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate
SMILESCC(C)c1cc(C(C)C)c(S(=O)(=O)Oc2cc(C3CCCC3)c(S(=O)(=O)[O-])c(C3CCCC3)c2)c(C(C)C)c1.CC(C)c1cc(C(C)C)c(S(=O)(=O)Oc2cc(C3CCCCC3)c(S(=O)(=O)[O-])c(C3CCCCC3)c2)c(C(C)C)c1.CC(C)c1cc(C(C)C)c(S(=O)(=O)Oc2ccc(S(=O)(=O)[O-])cc2)c(C(C)C)c1.Cc1cc(S(=O)(=O)[O-])c(C(C)C)cc1OC(=O)c1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1.Cc1cc(S(=O)(=O)[O-])c(C(C)C)cc1OS(=O)(=O)c1c(C(C)C)cc(C(C)C)cc1C(C)C.Cc1cc(S(=O)(=O)[O-])c(C(C)C)cc1OS(=O)(=O)c1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1
InChIInChI=1S/C35H48O5S.C34H48O6S2.C33H48O6S2.C31H44O6S2.C25H36O6S2.C21H28O6S2/c1-23(2)29-22-32(24(3)19-33(29)41(37,38)39)40-35(36)34-30(26-15-9-5-10-16-26)20-28(25-13-7-4-8-14-25)21-31(34)27-17-11-6-12-18-27;1-23(2)29-22-32(24(3)19-33(29)41(35,36)37)40-42(38,39)34-30(26-15-9-5-10-16-26)20-28(25-13-7-4-8-14-25)21-31(34)27-17-11-6-12-18-27;1-21(2)26-17-28(22(3)4)33(29(18-26)23(5)6)41(37,38)39-27-19-30(24-13-9-7-10-14-24)32(40(34,35)36)31(20-27)25-15-11-8-12-16-25;1-19(2)24-15-26(20(3)4)31(27(16-24)21(5)6)39(35,36)37-25-17-28(22-11-7-8-12-22)30(38(32,33)34)29(18-25)23-13-9-10-14-23;1-14(2)19-11-21(16(5)6)25(22(12-19)17(7)8)33(29,30)31-23-13-20(15(3)4)24(10-18(23)9)32(26,27)28;1-13(2)16-11-19(14(3)4)21(20(12-16)15(5)6)29(25,26)27-17-7-9-18(10-8-17)28(22,23)24/h19-23,25-27H,4-18H2,1-3H3,(H,37,38,39);19-23,25-27H,4-18H2,1-3H3,(H,35,36,37);17-25H,7-16H2,1-6H3,(H,34,35,36);15-23H,7-14H2,1-6H3,(H,32,33,34);10-17H,1-9H3,(H,26,27,28);7-15H,1-6H3,(H,22,23,24)/p-6
InChIKeyZILXTFLQMUAWAH-UHFFFAOYSA-H
MW3310.64 g/mol
LogP46.07
Rot. Bonds48

About 2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate

2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate (PubChem CID 162129455) has the molecular formula C179H246O35S11-6 and a molecular weight of 3310.64 g/mol. Its IUPAC name is 2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate.

Molecular Properties

Compound Name2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate
PubChem CID162129455
Molecular FormulaC179H246O35S11-6
Molecular Weight3310.64 g/mol
Exact Mass3307.44
IUPAC Name2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate
SMILESCC(C)c1cc(C(C)C)c(S(=O)(=O)Oc2cc(C3CCCC3)c(S(=O)(=O)[O-])c(C3CCCC3)c2)c(C(C)C)c1.CC(C)c1cc(C(C)C)c(S(=O)(=O)Oc2cc(C3CCCCC3)c(S(=O)(=O)[O-])c(C3CCCCC3)c2)c(C(C)C)c1.CC(C)c1cc(C(C)C)c(S(=O)(=O)Oc2ccc(S(=O)(=O)[O-])cc2)c(C(C)C)c1.Cc1cc(S(=O)(=O)[O-])c(C(C)C)cc1OC(=O)c1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1.Cc1cc(S(=O)(=O)[O-])c(C(C)C)cc1OS(=O)(=O)c1c(C(C)C)cc(C(C)C)cc1C(C)C.Cc1cc(S(=O)(=O)[O-])c(C(C)C)cc1OS(=O)(=O)c1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1
InChIInChI=1S/C35H48O5S.C34H48O6S2.C33H48O6S2.C31H44O6S2.C25H36O6S2.C21H28O6S2/c1-23(2)29-22-32(24(3)19-33(29)41(37,38)39)40-35(36)34-30(26-15-9-5-10-16-26)20-28(25-13-7-4-8-14-25)21-31(34)27-17-11-6-12-18-27;1-23(2)29-22-32(24(3)19-33(29)41(35,36)37)40-42(38,39)34-30(26-15-9-5-10-16-26)20-28(25-13-7-4-8-14-25)21-31(34)27-17-11-6-12-18-27;1-21(2)26-17-28(22(3)4)33(29(18-26)23(5)6)41(37,38)39-27-19-30(24-13-9-7-10-14-24)32(40(34,35)36)31(20-27)25-15-11-8-12-16-25;1-19(2)24-15-26(20(3)4)31(27(16-24)21(5)6)39(35,36)37-25-17-28(22-11-7-8-12-22)30(38(32,33)34)29(18-25)23-13-9-10-14-23;1-14(2)19-11-21(16(5)6)25(22(12-19)17(7)8)33(29,30)31-23-13-20(15(3)4)24(10-18(23)9)32(26,27)28;1-13(2)16-11-19(14(3)4)21(20(12-16)15(5)6)29(25,26)27-17-7-9-18(10-8-17)28(22,23)24/h19-23,25-27H,4-18H2,1-3H3,(H,37,38,39);19-23,25-27H,4-18H2,1-3H3,(H,35,36,37);17-25H,7-16H2,1-6H3,(H,34,35,36);15-23H,7-14H2,1-6H3,(H,32,33,34);10-17H,1-9H3,(H,26,27,28);7-15H,1-6H3,(H,22,23,24)/p-6
InChIKeyZILXTFLQMUAWAH-UHFFFAOYSA-H
XLogP46.07
TPSA586.35 Ų
H-Bond Donors
H-Bond Acceptors35
Rotatable Bonds48
Heavy Atoms225
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003310.64
LogP ≤ 546.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1035

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phenol_ester', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_1', 'substructure': 'N/A'}, {'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

Analyze 2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate with MolForge

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Launch Full Analysis

Related Compounds

4-[4-[4-[(3,6-Disulfo-1-naphthyl)oxycarbonyl]phenyl]benzoyl]oxynaphthalene-2,7-disulfonic acid
CID 455629
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-Methyl-4-prop-2-enoylsulfanylphenyl) 4-prop-2-enoylsulfanylbenzoate;bis((3-methyl-4-prop-2-enoylsulfanylphenyl) 4-prop-2-enoylsulfanylbenzoate);(4-prop-2-enoylsulfanylphenyl) 3-fluoro-4-prop-2-enoylsulfanylbenzoate;(4-prop-2-enoylsulfanylphenyl) 3-methyl-4-prop-2-enoylsulfanylbenzoate;(4-prop-2-enoylsulfanylphenyl) 4-prop-2-enoylsulfanyl-2-(trifluoromethyl)benzoate
CID 158733131
sodium;4-[(E)-[6-[(2,6-dimethylphenyl)methyl]-9-(2-sulfonatophenyl)xanthen-3-ylidene]methyl]-3,5-dimethylbenzenesulfonate;2-(2-methylprop-2-enoyloxy)ethyl 2-[(6E)-3-benzyl-6-benzylidenexanthen-9-yl]benzoate;2-(2-methylprop-2-enoyloxy)ethyl 2-[(6E)-3-propyl-6-propylidenexanthen-9-yl]benzoate;methylsulfonyl(trifluoromethylsulfonyl)azanide;trifluoro-[methylsulfonyl(trifluoromethylsulfonyl)methyl]sulfonylmethane
CID 158864908
Bis((2-methyl-4-prop-2-enoylsulfanylphenyl) 4-(2-methylprop-2-enoylsulfanyl)benzoate);bis((3-methyl-4-prop-2-enoylsulfanylphenyl) 4-(2-methylprop-2-enoylsulfanyl)benzoate);(4-prop-2-enoylsulfanylphenyl) 3-methyl-4-(2-methylprop-2-enoylsulfanyl)benzoate;(4-prop-2-enoylsulfanylphenyl) 4-(2-methylprop-2-enoylsulfanyl)-2-(trifluoromethyl)benzoate
CID 159281950
Bis([2-methyl-4-(2-methylprop-2-enoylsulfanyl)phenyl] 4-prop-2-enoylsulfanylbenzoate);[3-methyl-4-(2-methylprop-2-enoylsulfanyl)phenyl] 4-prop-2-enoylsulfanylbenzoate;[4-(2-methylprop-2-enoylsulfanyl)phenyl] 2-methyl-4-prop-2-enoylsulfanylbenzoate;[4-(2-methylprop-2-enoylsulfanyl)phenyl] 3-methyl-4-prop-2-enoylsulfanylbenzoate;[4-(2-methylprop-2-enoylsulfanyl)phenyl] 4-prop-2-enoylsulfanyl-2-(trifluoromethyl)benzoate
CID 159366459
(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
[2-Methyl-4-(2-methylprop-2-enoylsulfanyl)phenyl] 4-(2-methylprop-2-enoylsulfanyl)benzoate;[3-methyl-4-(2-methylprop-2-enoylsulfanyl)phenyl] 4-(2-methylprop-2-enoylsulfanyl)benzoate;[4-(2-methylprop-2-enoylsulfanyl)phenyl] 2-fluoro-4-(2-methylprop-2-enoylsulfanyl)benzoate;[4-(2-methylprop-2-enoylsulfanyl)phenyl] 3-fluoro-4-(2-methylprop-2-enoylsulfanyl)benzoate;[4-(2-methylprop-2-enoylsulfanyl)phenyl] 3-methyl-4-(2-methylprop-2-enoylsulfanyl)benzoate;[4-(2-methylprop-2-enoylsulfanyl)phenyl] 4-(2-methylprop-2-enoylsulfanyl)-2-(trifluoromethyl)benzoate
CID 161918761
2,3,5,6-Tetrafluoro-4-[4-(2,4,6-tricyclohexylbenzoyl)oxyphenyl]sulfonyloxybenzenesulfonate
CID 176603338
4-[6-[(2-Ethyl-2-adamantyl)oxycarbonyloxy]-7-fluoronaphthalene-2-carbonyl]oxy-5,6,7,8-tetrahydronaphthalene-1-sulfonate
CID 177111687
4-[4-[(3,6-Disulfo-1-naphthyl)oxycarbonyl]benzoyl]oxynaphthalene-2,7-disulfonic acid
CID 461016
4-[6-[(2-Ethyl-2-adamantyl)oxycarbonyloxy]-7-fluoronaphthalene-2-carbonyl]oxy-5,6,7,8-tetrahydronaphthalene-1-sulfonic acid
CID 177111688

Frequently Asked Questions

What is the IUPAC name of 2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate?
The IUPAC name of 2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate (CID 162129455) is 2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate.
What is the SMILES notation for 2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate?
The canonical SMILES for 2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate is CC(C)c1cc(C(C)C)c(S(=O)(=O)Oc2cc(C3CCCC3)c(S(=O)(=O)[O-])c(C3CCCC3)c2)c(C(C)C)c1.CC(C)c1cc(C(C)C)c(S(=O)(=O)Oc2cc(C3CCCCC3)c(S(=O)(=O)[O-])c(C3CCCCC3)c2)c(C(C)C)c1.CC(C)c1cc(C(C)C)c(S(=O)(=O)Oc2ccc(S(=O)(=O)[O-])cc2)c(C(C)C)c1.Cc1cc(S(=O)(=O)[O-])c(C(C)C)cc1OC(=O)c1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1.Cc1cc(S(=O)(=O)[O-])c(C(C)C)cc1OS(=O)(=O)c1c(C(C)C)cc(C(C)C)cc1C(C)C.Cc1cc(S(=O)(=O)[O-])c(C(C)C)cc1OS(=O)(=O)c1c(C2CCCCC2)cc(C2CCCCC2)cc1C1CCCCC1.
What is the InChIKey of 2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate?
The InChIKey is ZILXTFLQMUAWAH-UHFFFAOYSA-H. The full InChI is InChI=1S/C35H48O5S.C34H48O6S2.C33H48O6S2.C31H44O6S2.C25H36O6S2.C21H28O6S2/c1-23(2)29-22-32(24(3)19-33(29)41(37,38)39)40-35(36)34-30(26-15-9-5-10-16-26)20-28(25-13-7-4-8-14-25)21-31(34)27-17-11-6-12-18-27;1-23(2)29-22-32(24(3)19-33(29)41(35,36)37)40-42(38,39)34-30(26-15-9-5-10-16-26)20-28(25-13-7-4-8-14-25)21-31(34)27-17-11-6-12-18-27;1-21(2)26-17-28(22(3)4)33(29(18-26)23(5)6)41(37,38)39-27-19-30(24-13-9-7-10-14-24)32(40(34,35)36)31(20-27)25-15-11-8-12-16-25;1-19(2)24-15-26(20(3)4)31(27(16-24)21(5)6)39(35,36)37-25-17-28(22-11-7-8-12-22)30(38(32,33)34)29(18-25)23-13-9-10-14-23;1-14(2)19-11-21(16(5)6)25(22(12-19)17(7)8)33(29,30)31-23-13-20(15(3)4)24(10-18(23)9)32(26,27)28;1-13(2)16-11-19(14(3)4)21(20(12-16)15(5)6)29(25,26)27-17-7-9-18(10-8-17)28(22,23)24/h19-23,25-27H,4-18H2,1-3H3,(H,37,38,39);19-23,25-27H,4-18H2,1-3H3,(H,35,36,37);17-25H,7-16H2,1-6H3,(H,34,35,36);15-23H,7-14H2,1-6H3,(H,32,33,34);10-17H,1-9H3,(H,26,27,28);7-15H,1-6H3,(H,22,23,24)/p-6.
What are the key properties of 2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate?
2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate has a molecular weight of 3310.64 g/mol, XLogP of 46.07, 48 rotatable bonds, 0 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dicyclohexyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;2,6-dicyclopentyl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylbenzoyl)oxybenzenesulfonate;5-methyl-2-propan-2-yl-4-(2,4,6-tricyclohexylphenyl)sulfonyloxybenzenesulfonate;5-methyl-2-propan-2-yl-4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate;4-[2,4,6-tri(propan-2-yl)phenyl]sulfonyloxybenzenesulfonate is sourced from PubChem (CID 162129455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).