4-Amino-3-[[4-[[[4-[(8-Amino-1-Hydroxy-5-Sulpho-2-Naphthyl)Azo]Phenyl]Amino]Carbonyl]Phenyl]Azo]-5-Hydroxy-6-(Phenylazo)Naphthalene-2,7-Disulphonic Acid
[CAS# 54274-15-6]

Identification

• Name: 4-Amino-3-[[4-[[[4-[(8-Amino-1-Hydroxy-5-Sulpho-2-Naphthyl)Azo]Phenyl]Amino]Carbonyl]Phenyl]Azo]-5-Hydroxy-6-(Phenylazo)Naphthalene-2,7-Disulphonic Acid
• Synonyms: (6Z)-4-Amino-3-[4-[[4-[(N'z)-N'-(8-Amino-1-Oxo-5-Sulfo-2-Naphthylidene)Hydrazino]Phenyl]Carbamoyl]Phenyl]Azo-5-Oxo-6-(Phenylhydrazono)Naphthalene-2,7-Disulfonic Acid; (6Z)-4-Amino-3-[4-[[[4-[(N'z)-N'-(8-Amino-1-Oxo-5-Sulfo-2-Naphthylidene)Hydrazino]Phenyl]Amino]-Oxomethyl]Phenyl]Azo-5-Oxo-6-(Phenylhydrazono)Naphthalene-2,7-Disulfonic Acid; (6Z)-4-Amino-3-[4-[[4-[(N'z)-N'-(8-Amino-1-Keto-5-Sulfo-2-Naphthylidene)Hydrazino]Phenyl]Carbamoyl]Phenyl]Azo-5-Keto-6-(Phenylhydrazono)Naphthalene-2,7-Disulfonic Acid
• Molecular Formula: C₃₉H₂₉N₉O₁₂S₃
• Molecular Weight: 911.89
• CAS Registry Number: 54274-15-6
• EINECS: 259-059-8
• SMILES: C1=C7C(=C(N)C(=C1[S](O)(=O)=O)N=NC2=CC=C(C=C2)C(=O)NC5=CC=C(N\N=C4/C(=O)C3=C(N)C=CC(=C3C=C4)[S](O)(=O)=O)C=C5)C(=O)C(=N/NC6=CC=CC=C6)/C(=C7)[S](O)(=O)=O
• InChI: 1S/C39H29N9O12S3/c40-27-15-17-29(61(52,53)54)26-14-16-28(37(49)33(26)27)46-43-25-12-10-22(11-13-25)42-39(51)20-6-8-24(9-7-20)45-47-35-30(62(55,56)57)18-21-19-31(63(58,59)60)36(38(50)32(21)34(35)41)48-44-23-4-2-1-3-5-23/h1-19,43-44H,40-41H2,(H,42,51)(H,52,53,54)(H,55,56,57)(H,58,59,60)/b46-28-,47-45?,48-36+
• InChIKey: UXFCNZRSDLCYAU-ULPABPNTSA-N

Properties

• Density: 1.723g/cm³ (Cal.)