Methyl N-[5-(Acetylamino)-4-[(2-Bromo-4,6-Dinitrophenyl)Azo]-2-Methoxyphenyl]-N-Allylglycinate
[CAS# 57414-26-3]

Identification

• Name: Methyl N-[5-(Acetylamino)-4-[(2-Bromo-4,6-Dinitrophenyl)Azo]-2-Methoxyphenyl]-N-Allylglycinate
• Synonyms: Methyl 2-[[5-Acetamido-4-(2-Bromo-4,6-Dinitro-Phenyl)Azo-2-Methoxy-Phenyl]-Allyl-Amino]Acetate; 2-[[5-Acetamido-4-(2-Bromo-4,6-Dinitrophenyl)Azo-2-Methoxyphenyl]-Allylamino]Acetic Acid Methyl Ester; 2-[[5-Acetamido-4-(2-Bromo-4,6-Dinitro-Phenyl)Azo-2-Methoxy-Phenyl]-Allyl-Amino]Acetic Acid Methyl Ester
• Molecular Formula: C₂₁H₂₁BrN₆O₈
• Molecular Weight: 565.34
• CAS Registry Number: 57414-26-3
• EINECS: 260-727-6
• SMILES: C1=C(C=C(C(=C1Br)N=NC2=C(C=C(C(=C2)OC)N(CC=C)CC(=O)OC)NC(=O)C)[N+]([O-])=O)[N+]([O-])=O
• InChI: 1S/C21H21BrN6O8/c1-5-6-26(11-20(30)36-4)17-9-15(23-12(2)29)16(10-19(17)35-3)24-25-21-14(22)7-13(27(31)32)8-18(21)28(33)34/h5,7-10H,1,6,11H2,2-4H3,(H,23,29)
• InChIKey: ZBFUAGPRXUDDAB-UHFFFAOYSA-N

Properties

• Density: 1.547g/cm³ (Cal.)
• Boiling point: 747.921°C at 760 mmHg (Cal.)
• Flash point: 406.128°C (Cal.)