Dimethyl 2,2'-{1,4-Phenylenebis[Carbamoyl(2-Hydroxy-3,1-Naphthalenediyl)-2,1-Diazenediyl]}Bis(4-Chlorobenzoate)
[CAS# 42222-36-6]

Identification

• Name: Dimethyl 2,2'-{1,4-Phenylenebis[Carbamoyl(2-Hydroxy-3,1-Naphthalenediyl)-2,1-Diazenediyl]}Bis(4-Chlorobenzoate)
• Synonyms: Benzoic acid, 2,2'-[1,4-phenylenebis[iminocarbonyl(2-hydroxy-3,1-naphthalenediyl)azo]]bis[4-chloro-, dimethyl ester
• Molecular Formula: C₄₄H₃₀Cl₂N₆O₈
• Molecular Weight: 841.65
• CAS Registry Number: 42222-36-6
• SMILES: COC(=O)c1ccc(cc1N=Nc2c3ccccc3cc(c2O)C(=O)Nc4ccc(cc4)NC(=O)c5cc6ccccc6c(c5O)N=Nc7cc(ccc7C(=O)OC)Cl)Cl
• InChI: 1S/C44H30Cl2N6O8/c1-59-43(57)31-17-11-25(45)21-35(31)49-51-37-29-9-5-3-7-23(29)19-33(39(37)53)41(55)47-27-13-15-28(16-14-27)48-42(56)34-20-24-8-4-6-10-30(24)38(40(34)54)52-50-36-22-26(46)12-18-32(36)44(58)60-2/h3-22,53-54H,1-2H3,(H,47,55)(H,48,56)
• InChIKey: FQEWMFIEPYORTF-UHFFFAOYSA-N

Properties

• Density: 1.45g/cm³ (Cal.)
• Boiling point: 928.92°C at 760 mmHg (Cal.)
• Flash point: 515.593°C (Cal.)