Pentasodium 2-({5-[(2,4-disulfonatophenyl)diazenyl]-2,4-dihydroxyphenyl}diazenyl)-5-[4-({5-[(2,4-disulfonatophenyl)diazenyl]-2,4-dihydroxyphenyl}diazenyl)benzyl]benzoate
[CAS# 72089-21-5]

Identification

• Name: Pentasodium 2-({5-[(2,4-disulfonatophenyl)diazenyl]-2,4-dihydroxyphenyl}diazenyl)-5-[4-({5-[(2,4-disulfonatophenyl)diazenyl]-2,4-dihydroxyphenyl}diazenyl)benzyl]benzoate
• Synonyms: Benzoic acid, 2-[[5-[(2,4-disulfophenyl)azo]-2,4-dihydroxyphenyl]azo]-5-[[4-[[5-[(2,4-disulfophenyl)azo]-2,4-dihydroxyphenyl]azo]phenyl]methyl]-, pentasodium salt
• Molecular Formula: C₃₈H₂₃N₈Na₅O₁₈S₄
• Molecular Weight: 1122.84
• CAS Registry Number: 72089-21-5
• SMILES: c1cc(ccc1Cc2ccc(c(c2)C(=O)[O-])N=Nc3cc(c(cc3O)O)N=Nc4ccc(cc4S(=O)(=O)[O-])S(=O)(=O)[O-])N=Nc5cc(c(cc5O)O)N=Nc6ccc(cc6S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+]
• InChI: 1S/C38H28N8O18S4.5Na/c47-32-17-34(49)30(45-41-26-9-6-22(65(53,54)55)13-36(26)67(59,60)61)15-28(32)43-39-21-4-1-19(2-5-21)11-20-3-8-25(24(12-20)38(51)52)40-44-29-16-31(35(50)18-33(29)48)46-42-27-10-7-23(66(56,57)58)14-37(27)68(62,63)64;;;;;/h1-10,12-18,47-50H,11H2,(H,51,52)(H,53,54,55)(H,56,57,58)(H,59,60,61)(H,62,63,64);;;;;/q;5*+1/p-5
• InChIKey: BCHAQXGPLPOAIA-UHFFFAOYSA-I