trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione

C216H253Cl5N5Na3O34S6 — CID 162152174

IUPACtrisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione
SMILESC.CC(C)(C)c1cc(C(=O)Cl)cc(C(C)(C)C)c1O.CO.Cc1cc(C)c(Cc2ccccc2)c(C)c1CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.Cc1cc(C)c(Cc2ccccc2)c(C)c1N.Cc1cc(C)c(Nc2ccc(C(=C3C=CC(=[NH+]c4c(C)cc(C)c(CC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)c4C)C=C3)c3ccc(S(=O)(=O)[O-])cc3S(=O)(=O)[O-])cc2)c(C)c1CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.Cc1cc(C)c(Nc2ccc(C(c3ccc(Nc4c(C)cc(C)c(CC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)c4C)cc3)c3ccc(S(=O)(=O)O)cc3S(=O)(=O)O)cc2)c(C)c1CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.O=C1C(Cl)=C(Cl)C(=O)C(Cl)=C1Cl.O=Cc1ccc(S(=O)(=O)[O-])cc1S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChIInChI=1S/C69H82N2O10S2.C69H80N2O10S2.C32H40O2.C16H19N.C15H21ClO2.C7H6O7S2.C6Cl4O2.CH4O.CH4.3Na/c2*1-38-29-40(3)62(42(5)52(38)36-58(72)46-31-54(66(7,8)9)64(74)55(32-46)67(10,11)12)70-48-23-19-44(20-24-48)61(51-28-27-50(82(76,77)78)35-60(51)83(79,80)81)45-21-25-49(26-22-45)71-63-41(4)30-39(2)53(43(63)6)37-59(73)47-33-56(68(13,14)15)65(75)57(34-47)69(16,17)18;1-20-15-21(2)26(22(3)25(20)16-23-13-11-10-12-14-23)19-29(33)24-17-27(31(4,5)6)30(34)28(18-24)32(7,8)9;1-11-9-12(2)16(17)13(3)15(11)10-14-7-5-4-6-8-14;1-14(2,3)10-7-9(13(16)18)8-11(12(10)17)15(4,5)6;8-4-5-1-2-6(15(9,10)11)3-7(5)16(12,13)14;7-1-2(8)6(12)4(10)3(9)5(1)11;1-2;;;;/h19-35,61,70-71,74-75H,36-37H2,1-18H3,(H,76,77,78)(H,79,80,81);19-35,70,74-75H,36-37H2,1-18H3,(H,76,77,78)(H,79,80,81);10-15,17-18,34H,16,19H2,1-9H3;4-9H,10,17H2,1-3H3;7-8,17H,1-6H3;1-4H,(H,9,10,11)(H,12,13,14);;2H,1H3;1H4;;;/q;;;;;;;;;3*+1/p-3/b;61-45-,71-49+;;;;;;;;;;
InChIKeyULZBXJVAIXRFNL-UYFHYJGCSA-K
MW3902.04 g/mol
LogP38.63
Rot. Bonds39

About trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione

trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione (PubChem CID 162152174) has the molecular formula C216H253Cl5N5Na3O34S6 and a molecular weight of 3902.04 g/mol. Its IUPAC name is trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione.

Molecular Properties

Compound Nametrisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione
PubChem CID162152174
Molecular FormulaC216H253Cl5N5Na3O34S6
Molecular Weight3902.04 g/mol
Exact Mass3896.47
IUPAC Nametrisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione
SMILESC.CC(C)(C)c1cc(C(=O)Cl)cc(C(C)(C)C)c1O.CO.Cc1cc(C)c(Cc2ccccc2)c(C)c1CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.Cc1cc(C)c(Cc2ccccc2)c(C)c1N.Cc1cc(C)c(Nc2ccc(C(=C3C=CC(=[NH+]c4c(C)cc(C)c(CC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)c4C)C=C3)c3ccc(S(=O)(=O)[O-])cc3S(=O)(=O)[O-])cc2)c(C)c1CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.Cc1cc(C)c(Nc2ccc(C(c3ccc(Nc4c(C)cc(C)c(CC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)c4C)cc3)c3ccc(S(=O)(=O)O)cc3S(=O)(=O)O)cc2)c(C)c1CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.O=C1C(Cl)=C(Cl)C(=O)C(Cl)=C1Cl.O=Cc1ccc(S(=O)(=O)[O-])cc1S(=O)(=O)[O-].[Na+].[Na+].[Na+]
InChIInChI=1S/C69H82N2O10S2.C69H80N2O10S2.C32H40O2.C16H19N.C15H21ClO2.C7H6O7S2.C6Cl4O2.CH4O.CH4.3Na/c2*1-38-29-40(3)62(42(5)52(38)36-58(72)46-31-54(66(7,8)9)64(74)55(32-46)67(10,11)12)70-48-23-19-44(20-24-48)61(51-28-27-50(82(76,77)78)35-60(51)83(79,80)81)45-21-25-49(26-22-45)71-63-41(4)30-39(2)53(43(63)6)37-59(73)47-33-56(68(13,14)15)65(75)57(34-47)69(16,17)18;1-20-15-21(2)26(22(3)25(20)16-23-13-11-10-12-14-23)19-29(33)24-17-27(31(4,5)6)30(34)28(18-24)32(7,8)9;1-11-9-12(2)16(17)13(3)15(11)10-14-7-5-4-6-8-14;1-14(2,3)10-7-9(13(16)18)8-11(12(10)17)15(4,5)6;8-4-5-1-2-6(15(9,10)11)3-7(5)16(12,13)14;7-1-2(8)6(12)4(10)3(9)5(1)11;1-2;;;;/h19-35,61,70-71,74-75H,36-37H2,1-18H3,(H,76,77,78)(H,79,80,81);19-35,70,74-75H,36-37H2,1-18H3,(H,76,77,78)(H,79,80,81);10-15,17-18,34H,16,19H2,1-9H3;4-9H,10,17H2,1-3H3;7-8,17H,1-6H3;1-4H,(H,9,10,11)(H,12,13,14);;2H,1H3;1H4;;;/q;;;;;;;;;3*+1/p-3/b;61-45-,71-49+;;;;;;;;;;
InChIKeyULZBXJVAIXRFNL-UYFHYJGCSA-K
XLogP38.63
TPSA708.86 Ų
H-Bond Donors14
H-Bond Acceptors36
Rotatable Bonds39
Heavy Atoms269
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003902.04
LogP ≤ 538.63
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1036

Analyze trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione with MolForge

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Frequently Asked Questions

What is the IUPAC name of trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione?
The IUPAC name of trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione (CID 162152174) is trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione.
What is the SMILES notation for trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione?
The canonical SMILES for trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione is C.CC(C)(C)c1cc(C(=O)Cl)cc(C(C)(C)C)c1O.CO.Cc1cc(C)c(Cc2ccccc2)c(C)c1CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.Cc1cc(C)c(Cc2ccccc2)c(C)c1N.Cc1cc(C)c(Nc2ccc(C(=C3C=CC(=[NH+]c4c(C)cc(C)c(CC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)c4C)C=C3)c3ccc(S(=O)(=O)[O-])cc3S(=O)(=O)[O-])cc2)c(C)c1CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.Cc1cc(C)c(Nc2ccc(C(c3ccc(Nc4c(C)cc(C)c(CC(=O)c5cc(C(C)(C)C)c(O)c(C(C)(C)C)c5)c4C)cc3)c3ccc(S(=O)(=O)O)cc3S(=O)(=O)O)cc2)c(C)c1CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1.O=C1C(Cl)=C(Cl)C(=O)C(Cl)=C1Cl.O=Cc1ccc(S(=O)(=O)[O-])cc1S(=O)(=O)[O-].[Na+].[Na+].[Na+].
What is the InChIKey of trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione?
The InChIKey is ULZBXJVAIXRFNL-UYFHYJGCSA-K. The full InChI is InChI=1S/C69H82N2O10S2.C69H80N2O10S2.C32H40O2.C16H19N.C15H21ClO2.C7H6O7S2.C6Cl4O2.CH4O.CH4.3Na/c2*1-38-29-40(3)62(42(5)52(38)36-58(72)46-31-54(66(7,8)9)64(74)55(32-46)67(10,11)12)70-48-23-19-44(20-24-48)61(51-28-27-50(82(76,77)78)35-60(51)83(79,80)81)45-21-25-49(26-22-45)71-63-41(4)30-39(2)53(43(63)6)37-59(73)47-33-56(68(13,14)15)65(75)57(34-47)69(16,17)18;1-20-15-21(2)26(22(3)25(20)16-23-13-11-10-12-14-23)19-29(33)24-17-27(31(4,5)6)30(34)28(18-24)32(7,8)9;1-11-9-12(2)16(17)13(3)15(11)10-14-7-5-4-6-8-14;1-14(2,3)10-7-9(13(16)18)8-11(12(10)17)15(4,5)6;8-4-5-1-2-6(15(9,10)11)3-7(5)16(12,13)14;7-1-2(8)6(12)4(10)3(9)5(1)11;1-2;;;;/h19-35,61,70-71,74-75H,36-37H2,1-18H3,(H,76,77,78)(H,79,80,81);19-35,70,74-75H,36-37H2,1-18H3,(H,76,77,78)(H,79,80,81);10-15,17-18,34H,16,19H2,1-9H3;4-9H,10,17H2,1-3H3;7-8,17H,1-6H3;1-4H,(H,9,10,11)(H,12,13,14);;2H,1H3;1H4;;;/q;;;;;;;;;3*+1/p-3/b;61-45-,71-49+;;;;;;;;;;.
What are the key properties of trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione?
trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione has a molecular weight of 3902.04 g/mol, XLogP of 38.63, 39 rotatable bonds, 14 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for trisodium;3-benzyl-2,4,6-trimethylaniline;2-(3-benzyl-2,4,6-trimethylphenyl)-1-(3,5-ditert-butyl-4-hydroxyphenyl)ethanone;4-[bis[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]methyl]benzene-1,3-disulfonic acid;3,5-ditert-butyl-4-hydroxybenzoyl chloride;4-[[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylanilino]phenyl]-[4-[3-[2-(3,5-ditert-butyl-4-hydroxyphenyl)-2-oxoethyl]-2,4,6-trimethylphenyl]azaniumylidenecyclohexa-2,5-dien-1-ylidene]methyl]benzene-1,3-disulfonate;4-formylbenzene-1,3-disulfonate;methane;methanol;2,3,5,6-tetrachlorocyclohexa-2,5-diene-1,4-dione is sourced from PubChem (CID 162152174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).