4,4'-Bis({1-[(4-chloro-2,5-dimethoxyphenyl)amino]-1,3-dioxo-2-butanyl}diazenyl)-2,2'-biphenyldisulfonic acid
[CAS# 85030-61-1]

Identification

• Name: 4,4'-Bis({1-[(4-chloro-2,5-dimethoxyphenyl)amino]-1,3-dioxo-2-butanyl}diazenyl)-2,2'-biphenyldisulfonic acid
• Synonyms: 4,4'-bis[[1-[[(4-chloro-2,5-dimethoxyphenyl)amino]carbonyl]-2-oxopropyl]azo][1,1'-biphenyl]-2,2'-disulphonic acid
• Molecular Formula: C₃₆H₃₄Cl₂N₆O₁₄S₂
• Molecular Weight: 909.72
• CAS Registry Number: 85030-61-1
• EINECS: 285-187-9
• SMILES: COc4cc(NC(=O)C(N=Nc3ccc(c2ccc(N=NC(C(C)=O)C(=O)Nc1cc(OC)c(Cl)cc1OC)cc2S(O)(=O)=O)c(c3)S(O)(=O)=O)C(C)=O)c(cc4Cl)OC
• InChI: 1S/C36H34Cl2N6O14S2/c1-17(45)33(35(47)39-25-15-27(55-3)23(37)13-29(25)57-5)43-41-19-7-9-21(31(11-19)59(49,50)51)22-10-8-20(12-32(22)60(52,53)54)42-44-34(18(2)46)36(48)40-26-16-28(56-4)24(38)14-30(26)58-6/h7-16,33-34H,1-6H3,(H,39,47)(H,40,48)(H,49,50,51)(H,52,53,54)
• InChIKey: OCAWVJGJFRRZLG-UHFFFAOYSA-N

Properties

• Density: 1.548g/cm³ (Cal.)