2-{[3-({3-[(2,5-Dimethoxyphenyl)carbamoyl]-2-hydroxy-1-naphthyl}diazenyl)-4-methoxyphenyl]sulfonyl}ethyl propionate
[CAS# 85959-36-0]

Identification

• Name: 2-{[3-({3-[(2,5-Dimethoxyphenyl)carbamoyl]-2-hydroxy-1-naphthyl}diazenyl)-4-methoxyphenyl]sulfonyl}ethyl propionate
• Synonyms: N-(2,5-dimethoxyphenyl)-3-hydroxy-4-[[2-methoxy-5-[[2-(1-oxopropoxy)ethyl]sulphonyl]phenyl]azo]naphthalene-2-carboxamide
• Molecular Formula: C₃₁H₃₁N₃O₉S
• Molecular Weight: 621.66
• CAS Registry Number: 85959-36-0
• EINECS: 289-028-4
• SMILES: COc4ccc(cc4N=Nc2c3ccccc3cc(C(=O)Nc1cc(OC)ccc1OC)c2O)S(=O)(=O)CCOC(=O)CC
• InChI: 1S/C31H31N3O9S/c1-5-28(35)43-14-15-44(38,39)21-11-13-27(42-4)25(18-21)33-34-29-22-9-7-6-8-19(22)16-23(30(29)36)31(37)32-24-17-20(40-2)10-12-26(24)41-3/h6-13,16-18,36H,5,14-15H2,1-4H3,(H,32,37)
• InChIKey: RUCHFDRICGABHM-UHFFFAOYSA-N

Properties

• Density: 1.336g/cm³ (Cal.)
• Boiling point: 791.946°C at 760 mmHg (Cal.)
• Flash point: 432.754°C (Cal.)