4,5,6,7-Tetrachloro-3-[[3-Methyl-4-[[4-[(4,5,6,7-Tetrachloro-1-Oxo-1H-Isoindol-3-Yl)Amino]Phenyl]Azo]Phenyl]Amino]-1H-Isoindol-1-One
[CAS# 40716-47-0]

Identification

• Name: 4,5,6,7-Tetrachloro-3-[[3-Methyl-4-[[4-[(4,5,6,7-Tetrachloro-1-Oxo-1H-Isoindol-3-Yl)Amino]Phenyl]Azo]Phenyl]Amino]-1H-Isoindol-1-One
• Synonyms: 4,5,6,7-Tetrachloro-3-[[3-Methyl-4-[4-[(4,5,6,7-Tetrachloro-3-Oxo-Isoindol-1-Yl)Amino]Phenyl]Azo-Phenyl]Amino]Isoindol-1-One; 4,5,6,7-Tetrachloro-3-[[3-Methyl-4-[4-[(4,5,6,7-Tetrachloro-3-Oxo-1-Isoindolyl)Amino]Phenyl]Azophenyl]Amino]-1-Isoindolone; 4,5,6,7-Tetrachloro-3-[[3-Methyl-4-[4-[(4,5,6,7-Tetrachloro-3-Keto-Isoindol-1-Yl)Amino]Phenyl]Azo-Phenyl]Amino]Isoindol-1-One
• Molecular Formula: C₂₉H₁₂Cl₈N₆O₂
• Molecular Weight: 760.08
• CAS Registry Number: 40716-47-0
• EINECS: 255-052-9
• SMILES: C1=C(C)C(=CC=C1NC2=NC(C3=C(C(=C(C(=C23)Cl)Cl)Cl)Cl)=O)N=NC4=CC=C(C=C4)NC5=NC(=O)C6=C5C(=C(C(=C6Cl)Cl)Cl)Cl
• InChI: 1S/C29H12Cl8N6O2/c1-9-8-12(39-27-15-17(29(45)41-27)21(33)25(37)23(35)19(15)31)6-7-13(9)43-42-11-4-2-10(3-5-11)38-26-14-16(28(44)40-26)20(32)24(36)22(34)18(14)30/h2-8H,1H3,(H,38,40,44)(H,39,41,45)
• InChIKey: XSYQXXVSXOYVET-UHFFFAOYSA-N

Properties

• Density: 1.794g/cm³ (Cal.)
• Boiling point: 898.487°C at 760 mmHg (Cal.)
• Flash point: 497.187°C (Cal.)