5-[[4-[[[4-[[8-Amino-1-Hydroxy-7-[(4-Nitrophenyl)Azo]-3,6-Disulpho-2-Naphthyl]Azo]Phenyl]Amino]Carbonyl]Phenyl]Azo]Salicylic Acid
[CAS# 56918-93-5]

Identification

• Name: 5-[[4-[[[4-[[8-Amino-1-Hydroxy-7-[(4-Nitrophenyl)Azo]-3,6-Disulpho-2-Naphthyl]Azo]Phenyl]Amino]Carbonyl]Phenyl]Azo]Salicylic Acid
• Synonyms: Benzoic Acid, 5-((4-(((4-((8-Amino-1-Hydroxy-7-((4-Nitrophenyl)Azo)-3,6-Disulfo-2-Naphthalenyl)Azo)Phenyl)Amino)Carbonyl)Phenyl)Azo)-2-Hydroxy-
• Molecular Formula: C₃₆H₂₅N₉O₁₃S₂
• Molecular Weight: 855.77
• CAS Registry Number: 56918-93-5
• EINECS: 260-433-8
• SMILES: C1=C6C(=C(O)C(=C1[S](O)(=O)=O)N=NC4=CC=C(NC(=O)C3=CC=C(N=NC2=CC=C(O)C(=C2)C(O)=O)C=C3)C=C4)C(=C(N=NC5=CC=C([N+]([O-])=O)C=C5)C(=C6)[S](O)(=O)=O)N
• InChI: 1S/C36H25N9O13S2/c37-31-30-19(15-28(59(53,54)55)32(31)43-40-23-9-12-25(13-10-23)45(51)52)16-29(60(56,57)58)33(34(30)47)44-41-22-7-5-20(6-8-22)38-35(48)18-1-3-21(4-2-18)39-42-24-11-14-27(46)26(17-24)36(49)50/h1-17,46-47H,37H2,(H,38,48)(H,49,50)(H,53,54,55)(H,56,57,58)
• InChIKey: MMVNZWAJOBFTMS-UHFFFAOYSA-N

Properties

• Density: 1.72g/cm³ (Cal.)