Methyl N-[5-(Acetylamino)-4-[(2,4-Dinitrophenyl)Azo]-2-Methoxyphenyl]-N-(3-Methoxy-3-Oxopropyl)-beta-Alaninate
[CAS# 62072-81-5]

Identification

• Name: Methyl N-[5-(Acetylamino)-4-[(2,4-Dinitrophenyl)Azo]-2-Methoxyphenyl]-N-(3-Methoxy-3-Oxopropyl)-beta-Alaninate
• Synonyms: Methyl 3-[[5-Acetamido-4-(2,4-Dinitrophenyl)Azo-2-Methoxy-Phenyl]-(3-Methoxy-3-Oxo-Propyl)Amino]Propanoate; 3-[[5-Acetamido-4-(2,4-Dinitrophenyl)Azo-2-Methoxyphenyl]-(3-Methoxy-3-Oxopropyl)Amino]Propanoic Acid Methyl Ester; 3-[[5-Acetamido-4-(2,4-Dinitrophenyl)Azo-2-Methoxy-Phenyl]-(3-Keto-3-Methoxy-Propyl)Amino]Propionic Acid Methyl Ester
• Molecular Formula: C₂₃H₂₆N₆O₁₀
• Molecular Weight: 546.49
• CAS Registry Number: 62072-81-5
• EINECS: 263-395-0
• SMILES: C1=CC(=C(C=C1[N+]([O-])=O)[N+]([O-])=O)N=NC2=C(C=C(C(=C2)OC)N(CCC(=O)OC)CCC(=O)OC)NC(=O)C
• InChI: 1S/C23H26N6O10/c1-14(30)24-17-12-20(27(9-7-22(31)38-3)10-8-23(32)39-4)21(37-2)13-18(17)26-25-16-6-5-15(28(33)34)11-19(16)29(35)36/h5-6,11-13H,7-10H2,1-4H3,(H,24,30)
• InChIKey: PRXVOZRQJNSLIB-UHFFFAOYSA-N

Properties

• Density: 1.406g/cm³ (Cal.)
• Boiling point: 765.091°C at 760 mmHg (Cal.)
• Flash point: 416.512°C (Cal.)