3,3'-[(4,6-Disulfo-1,3-phenylene)bis[azo(4,6-diamino-3,1-phenylene)azo(3,3'-dimethyl[1,1'-biphenyl]-4',4-diyl)azo]]bis[6-hydroxy-Benzoic acid) tetrasodium salt
[CAS# 6471-42-7]

Identification

• Name: 3,3'-[(4,6-Disulfo-1,3-phenylene)bis[azo(4,6-diamino-3,1-phenylene)azo(3,3'-dimethyl[1,1'-biphenyl]-4',4-diyl)azo]]bis[6-hydroxy-Benzoic acid) tetrasodium salt
• Synonyms: N-(2-Methylphenyl)-N-[2-Oxo-2-(4-Phenyl-1-Piperazinyl)Ethyl]Benzenesulfonamide; N-[2-Keto-2-(4-Phenylpiperazin-1-Yl)Ethyl]-N-(2-Methylphenyl)Benzenesulfonamide
• Molecular Formula: C₂₅H₂₇N₃O₃S
• Molecular Weight: 449.57
• CAS Registry Number: 6471-42-7
• SMILES: C1=CC=CC(=C1N([S](=O)(=O)C2=CC=CC=C2)CC(N3CCN(CC3)C4=CC=CC=C4)=O)C
• InChI: 1S/C25H27N3O3S/c1-21-10-8-9-15-24(21)28(32(30,31)23-13-6-3-7-14-23)20-25(29)27-18-16-26(17-19-27)22-11-4-2-5-12-22/h2-15H,16-20H2,1H3
• InChIKey: BILMFPOBGJVTAH-UHFFFAOYSA-N

Properties

• Density: 1.276g/cm³ (Cal.)
• Boiling point: 650.446°C at 760 mmHg (Cal.)
• Flash point: 347.177°C (Cal.)