Ethyl N-[3-(Acetylamino)-4-[(2-Chloro-4-Nitrophenyl)Azo]Phenyl]-N-(3-Ethoxy-3-Oxopropyl)-beta-Alaninate
[CAS# 68134-40-7]

Identification

• Name: Ethyl N-[3-(Acetylamino)-4-[(2-Chloro-4-Nitrophenyl)Azo]Phenyl]-N-(3-Ethoxy-3-Oxopropyl)-beta-Alaninate
• Synonyms: Ethyl 3-[[3-Acetamido-4-(2-Chloro-4-Nitro-Phenyl)Azo-Phenyl]-(3-Ethoxy-3-Oxo-Propyl)Amino]Propanoate; 3-[[3-Acetamido-4-(2-Chloro-4-Nitrophenyl)Azophenyl]-(3-Ethoxy-3-Oxopropyl)Amino]Propanoic Acid Ethyl Ester; 3-[[3-Acetamido-4-(2-Chloro-4-Nitro-Phenyl)Azo-Phenyl]-(3-Ethoxy-3-Keto-Propyl)Amino]Propionic Acid Ethyl Ester
• Molecular Formula: C₂₄H₂₈ClN₅O₇
• Molecular Weight: 533.97
• CAS Registry Number: 68134-40-7
• EINECS: 268-752-4
• SMILES: C1=C(C=CC(=C1Cl)N=NC2=C(C=C(C=C2)N(CCC(=O)OCC)CCC(=O)OCC)NC(=O)C)[N+]([O-])=O
• InChI: 1S/C24H28ClN5O7/c1-4-36-23(32)10-12-29(13-11-24(33)37-5-2)17-6-9-21(22(15-17)26-16(3)31)28-27-20-8-7-18(30(34)35)14-19(20)25/h6-9,14-15H,4-5,10-13H2,1-3H3,(H,26,31)
• InChIKey: UBJAEZNYIDXOAJ-UHFFFAOYSA-N

Properties

• Density: 1.324g/cm³ (Cal.)
• Boiling point: 719.496°C at 760 mmHg (Cal.)
• Flash point: 388.937°C (Cal.)