Diisopropyl 3,3'-{(2-chloro-5-methyl-1,4-phenylene)bis[carbamoyl(2-hydroxy-3,1-naphthalenediyl)-2,1-diazenediyl]}bis(4-methylbenzoate)
[CAS# 71832-84-3]

Identification

• Name: Diisopropyl 3,3'-{(2-chloro-5-methyl-1,4-phenylene)bis[carbamoyl(2-hydroxy-3,1-naphthalenediyl)-2,1-diazenediyl]}bis(4-methylbenzoate)
• Synonyms: Benzoic acid, 3,3'-[(2-chloro-5-methyl-1,4-phenylene)bis[iminocarbonyl(2-hydroxy-3,1-naphthalenediyl)azo]]bis[4-methyl-, bis(1-methylethyl) ester
• Molecular Formula: C₅₁H₄₅ClN₆O₈
• Molecular Weight: 905.39
• CAS Registry Number: 71832-84-3
• SMILES: Cc1ccc(cc1N=Nc2c3ccccc3cc(c2O)C(=O)Nc4cc(c(cc4Cl)NC(=O)c5cc6ccccc6c(c5O)N=Nc7cc(ccc7C)C(=O)OC(C)C)C)C(=O)OC(C)C
• InChI: 1S/C51H45ClN6O8/c1-26(2)65-50(63)33-18-16-28(5)41(23-33)55-57-44-35-14-10-8-12-31(35)21-37(46(44)59)48(61)53-40-25-39(52)43(20-30(40)7)54-49(62)38-22-32-13-9-11-15-36(32)45(47(38)60)58-56-42-24-34(19-17-29(42)6)51(64)66-27(3)4/h8-27,59-60H,1-7H3,(H,53,61)(H,54,62)
• InChIKey: QUKNAAFVUHKXMH-UHFFFAOYSA-N

Properties

• Density: 1.333g/cm³ (Cal.)
• Boiling point: 952.006°C at 760 mmHg (Cal.)
• Flash point: 529.554°C (Cal.)