4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol

C335H378O36S2 — CID 161288001

IUPAC4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol
SMILESC=CCc1cc(Oc2cc(CC=C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)cc(Cc2cc(C)c(O)c(C)c2)c1O.C=CCc1cc(Sc2cc(CC=C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)cc(Cc2cc(C)c(O)c(C)c2)c1O.Cc1cc(C(C)(C)c2cc(C)c(O)c(Cc3cc(C(C)(C)c4cc(C)c(O)c(C)c4)cc(C)c3O)c2)cc(C)c1O.Cc1cc(C(C)(C)c2ccc(C(C)(c3cc(C)c(O)c(C)c3)c3cc(C)c(O)c(C)c3)cc2)cc(C)c1O.Cc1cc(C2(c3cc(C)c(O)c(C)c3)CCC(c3cc(C)c(O)c(C)c3)(c3cc(C)c(O)c(C)c3)CC2)cc(C)c1O.Cc1cc(Cc2cc(C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)c(O)c(Cc2cc(C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)c1.Cc1cc(Cc2cc(C3(C)CCC(C(C)(C)c4cc(C)c(O)c(Cc5cc(C)c(O)c(C)c5)c4)CC3)cc(C)c2O)cc(C)c1O.Cc1cc(Cc2cc(C3(c4cc(C)c(O)c(Cc5cc(C)c(O)c(C)c5)c4)CCCCC3)cc(C)c2O)cc(C)c1O.Cc1cc(Sc2ccc(C(C)(c3cc(C)c(O)c(C)c3)c3cc(C)c(O)c(C)c3)cc2)cc(C)c1O
InChIInChI=1S/C42H52O4.C41H44O5.2C38H44O4.C37H44O4.C36H38O5.C36H38O4S.C35H40O3.C32H34O3S/c1-24-14-30(15-25(2)37(24)43)20-32-22-35(18-28(5)39(32)45)41(7,8)34-10-12-42(9,13-11-34)36-19-29(6)40(46)33(23-36)21-31-16-26(3)38(44)27(4)17-31;1-22-8-33(18-31-14-27(6)39(44)35(20-31)16-29-10-23(2)37(42)24(3)11-29)41(46)34(9-22)19-32-15-28(7)40(45)36(21-32)17-30-12-25(4)38(43)26(5)13-30;1-21-13-29(14-22(2)33(21)39)37(30-15-23(3)34(40)24(4)16-30)9-11-38(12-10-37,31-17-25(5)35(41)26(6)18-31)32-19-27(7)36(42)28(8)20-32;1-22-12-28(13-23(2)34(22)39)18-30-20-32(16-26(5)36(30)41)38(10-8-7-9-11-38)33-17-27(6)37(42)31(21-33)19-29-14-24(3)35(40)25(4)15-29;1-20-11-28(12-21(2)32(20)38)36(7,8)30-15-24(5)34(40)26(18-30)17-27-19-31(16-25(6)35(27)41)37(9,10)29-13-22(3)33(39)23(4)14-29;2*1-7-9-27-17-31(19-29(35(27)39)15-25-11-21(3)33(37)22(4)12-25)41-32-18-28(10-8-2)36(40)30(20-32)16-26-13-23(5)34(38)24(6)14-26;1-20-14-28(15-21(2)31(20)36)34(7,8)26-10-12-27(13-11-26)35(9,29-16-22(3)32(37)23(4)17-29)30-18-24(5)33(38)25(6)19-30;1-18-12-25(13-19(2)29(18)33)32(7,26-14-20(3)30(34)21(4)15-26)24-8-10-27(11-9-24)36-28-16-22(5)31(35)23(6)17-28/h14-19,22-23,34,43-46H,10-13,20-21H2,1-9H3;8-15,20-21,42-46H,16-19H2,1-7H3;13-20,39-42H,9-12H2,1-8H3;12-17,20-21,39-42H,7-11,18-19H2,1-6H3;11-16,18-19,38-41H,17H2,1-10H3;2*7-8,11-14,17-20,37-40H,1-2,9-10,15-16H2,3-6H3;10-19,36-38H,1-9H3;8-17,33-35H,1-7H3
InChIKeyVFZALGGBYNZYOS-UHFFFAOYSA-N
MW5044.81 g/mol
LogP78.12
Rot. Bonds61

About 4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol

4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol (PubChem CID 161288001) has the molecular formula C335H378O36S2 and a molecular weight of 5044.81 g/mol. Its IUPAC name is 4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol.

Molecular Properties

Compound Name4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol
PubChem CID161288001
Molecular FormulaC335H378O36S2
Molecular Weight5044.81 g/mol
Exact Mass5040.72
IUPAC Name4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol
SMILESC=CCc1cc(Oc2cc(CC=C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)cc(Cc2cc(C)c(O)c(C)c2)c1O.C=CCc1cc(Sc2cc(CC=C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)cc(Cc2cc(C)c(O)c(C)c2)c1O.Cc1cc(C(C)(C)c2cc(C)c(O)c(Cc3cc(C(C)(C)c4cc(C)c(O)c(C)c4)cc(C)c3O)c2)cc(C)c1O.Cc1cc(C(C)(C)c2ccc(C(C)(c3cc(C)c(O)c(C)c3)c3cc(C)c(O)c(C)c3)cc2)cc(C)c1O.Cc1cc(C2(c3cc(C)c(O)c(C)c3)CCC(c3cc(C)c(O)c(C)c3)(c3cc(C)c(O)c(C)c3)CC2)cc(C)c1O.Cc1cc(Cc2cc(C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)c(O)c(Cc2cc(C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)c1.Cc1cc(Cc2cc(C3(C)CCC(C(C)(C)c4cc(C)c(O)c(Cc5cc(C)c(O)c(C)c5)c4)CC3)cc(C)c2O)cc(C)c1O.Cc1cc(Cc2cc(C3(c4cc(C)c(O)c(Cc5cc(C)c(O)c(C)c5)c4)CCCCC3)cc(C)c2O)cc(C)c1O.Cc1cc(Sc2ccc(C(C)(c3cc(C)c(O)c(C)c3)c3cc(C)c(O)c(C)c3)cc2)cc(C)c1O
InChIInChI=1S/C42H52O4.C41H44O5.2C38H44O4.C37H44O4.C36H38O5.C36H38O4S.C35H40O3.C32H34O3S/c1-24-14-30(15-25(2)37(24)43)20-32-22-35(18-28(5)39(32)45)41(7,8)34-10-12-42(9,13-11-34)36-19-29(6)40(46)33(23-36)21-31-16-26(3)38(44)27(4)17-31;1-22-8-33(18-31-14-27(6)39(44)35(20-31)16-29-10-23(2)37(42)24(3)11-29)41(46)34(9-22)19-32-15-28(7)40(45)36(21-32)17-30-12-25(4)38(43)26(5)13-30;1-21-13-29(14-22(2)33(21)39)37(30-15-23(3)34(40)24(4)16-30)9-11-38(12-10-37,31-17-25(5)35(41)26(6)18-31)32-19-27(7)36(42)28(8)20-32;1-22-12-28(13-23(2)34(22)39)18-30-20-32(16-26(5)36(30)41)38(10-8-7-9-11-38)33-17-27(6)37(42)31(21-33)19-29-14-24(3)35(40)25(4)15-29;1-20-11-28(12-21(2)32(20)38)36(7,8)30-15-24(5)34(40)26(18-30)17-27-19-31(16-25(6)35(27)41)37(9,10)29-13-22(3)33(39)23(4)14-29;2*1-7-9-27-17-31(19-29(35(27)39)15-25-11-21(3)33(37)22(4)12-25)41-32-18-28(10-8-2)36(40)30(20-32)16-26-13-23(5)34(38)24(6)14-26;1-20-14-28(15-21(2)31(20)36)34(7,8)26-10-12-27(13-11-26)35(9,29-16-22(3)32(37)23(4)17-29)30-18-24(5)33(38)25(6)19-30;1-18-12-25(13-19(2)29(18)33)32(7,26-14-20(3)30(34)21(4)15-26)24-8-10-27(11-9-24)36-28-16-22(5)31(35)23(6)17-28/h14-19,22-23,34,43-46H,10-13,20-21H2,1-9H3;8-15,20-21,42-46H,16-19H2,1-7H3;13-20,39-42H,9-12H2,1-8H3;12-17,20-21,39-42H,7-11,18-19H2,1-6H3;11-16,18-19,38-41H,17H2,1-10H3;2*7-8,11-14,17-20,37-40H,1-2,9-10,15-16H2,3-6H3;10-19,36-38H,1-9H3;8-17,33-35H,1-7H3
InChIKeyVFZALGGBYNZYOS-UHFFFAOYSA-N
XLogP78.12
TPSA717.28 Ų
H-Bond Donors35
H-Bond Acceptors38
Rotatable Bonds61
Heavy Atoms373
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5005044.81
LogP ≤ 578.12
H-Bond Donors ≤ 535
H-Bond Acceptors ≤ 1038

Analyze 4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol?
The IUPAC name of 4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol (CID 161288001) is 4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol.
What is the SMILES notation for 4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol?
The canonical SMILES for 4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol is C=CCc1cc(Oc2cc(CC=C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)cc(Cc2cc(C)c(O)c(C)c2)c1O.C=CCc1cc(Sc2cc(CC=C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)cc(Cc2cc(C)c(O)c(C)c2)c1O.Cc1cc(C(C)(C)c2cc(C)c(O)c(Cc3cc(C(C)(C)c4cc(C)c(O)c(C)c4)cc(C)c3O)c2)cc(C)c1O.Cc1cc(C(C)(C)c2ccc(C(C)(c3cc(C)c(O)c(C)c3)c3cc(C)c(O)c(C)c3)cc2)cc(C)c1O.Cc1cc(C2(c3cc(C)c(O)c(C)c3)CCC(c3cc(C)c(O)c(C)c3)(c3cc(C)c(O)c(C)c3)CC2)cc(C)c1O.Cc1cc(Cc2cc(C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)c(O)c(Cc2cc(C)c(O)c(Cc3cc(C)c(O)c(C)c3)c2)c1.Cc1cc(Cc2cc(C3(C)CCC(C(C)(C)c4cc(C)c(O)c(Cc5cc(C)c(O)c(C)c5)c4)CC3)cc(C)c2O)cc(C)c1O.Cc1cc(Cc2cc(C3(c4cc(C)c(O)c(Cc5cc(C)c(O)c(C)c5)c4)CCCCC3)cc(C)c2O)cc(C)c1O.Cc1cc(Sc2ccc(C(C)(c3cc(C)c(O)c(C)c3)c3cc(C)c(O)c(C)c3)cc2)cc(C)c1O.
What is the InChIKey of 4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol?
The InChIKey is VFZALGGBYNZYOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H52O4.C41H44O5.2C38H44O4.C37H44O4.C36H38O5.C36H38O4S.C35H40O3.C32H34O3S/c1-24-14-30(15-25(2)37(24)43)20-32-22-35(18-28(5)39(32)45)41(7,8)34-10-12-42(9,13-11-34)36-19-29(6)40(46)33(23-36)21-31-16-26(3)38(44)27(4)17-31;1-22-8-33(18-31-14-27(6)39(44)35(20-31)16-29-10-23(2)37(42)24(3)11-29)41(46)34(9-22)19-32-15-28(7)40(45)36(21-32)17-30-12-25(4)38(43)26(5)13-30;1-21-13-29(14-22(2)33(21)39)37(30-15-23(3)34(40)24(4)16-30)9-11-38(12-10-37,31-17-25(5)35(41)26(6)18-31)32-19-27(7)36(42)28(8)20-32;1-22-12-28(13-23(2)34(22)39)18-30-20-32(16-26(5)36(30)41)38(10-8-7-9-11-38)33-17-27(6)37(42)31(21-33)19-29-14-24(3)35(40)25(4)15-29;1-20-11-28(12-21(2)32(20)38)36(7,8)30-15-24(5)34(40)26(18-30)17-27-19-31(16-25(6)35(27)41)37(9,10)29-13-22(3)33(39)23(4)14-29;2*1-7-9-27-17-31(19-29(35(27)39)15-25-11-21(3)33(37)22(4)12-25)41-32-18-28(10-8-2)36(40)30(20-32)16-26-13-23(5)34(38)24(6)14-26;1-20-14-28(15-21(2)31(20)36)34(7,8)26-10-12-27(13-11-26)35(9,29-16-22(3)32(37)23(4)17-29)30-18-24(5)33(38)25(6)19-30;1-18-12-25(13-19(2)29(18)33)32(7,26-14-20(3)30(34)21(4)15-26)24-8-10-27(11-9-24)36-28-16-22(5)31(35)23(6)17-28/h14-19,22-23,34,43-46H,10-13,20-21H2,1-9H3;8-15,20-21,42-46H,16-19H2,1-7H3;13-20,39-42H,9-12H2,1-8H3;12-17,20-21,39-42H,7-11,18-19H2,1-6H3;11-16,18-19,38-41H,17H2,1-10H3;2*7-8,11-14,17-20,37-40H,1-2,9-10,15-16H2,3-6H3;10-19,36-38H,1-9H3;8-17,33-35H,1-7H3.
What are the key properties of 4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol?
4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol has a molecular weight of 5044.81 g/mol, XLogP of 78.12, 61 rotatable bonds, 35 hydrogen bond donors, and 38 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-[1,1-bis(4-hydroxy-3,5-dimethylphenyl)ethyl]phenyl]propan-2-yl]-2,6-dimethylphenol;2,6-bis[[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]methyl]-4-methylphenol;2,6-dimethyl-4-[1,4,4-tris(4-hydroxy-3,5-dimethylphenyl)cyclohexyl]phenol;4-[1-(4-hydroxy-3,5-dimethylphenyl)-1-[4-(4-hydroxy-3,5-dimethylphenyl)sulfanylphenyl]ethyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[1-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]cyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-[2-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-methylphenyl]propan-2-yl]-1-methylcyclohexyl]-3-methylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenoxy]-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[[2-hydroxy-5-[4-hydroxy-3-[(4-hydroxy-3,5-dimethylphenyl)methyl]-5-prop-2-enylphenyl]sulfanyl-3-prop-2-enylphenyl]methyl]-2,6-dimethylphenol;4-[2-[4-hydroxy-3-[[2-hydroxy-5-[2-(4-hydroxy-3,5-dimethylphenyl)propan-2-yl]-3-methylphenyl]methyl]-5-methylphenyl]propan-2-yl]-2,6-dimethylphenol is sourced from PubChem (CID 161288001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).