Methyl N-{3-acetamido-4-[(2-cyano-4,6-dinitrophenyl)diazenyl]phenyl}-N-ethyl-beta-alaninate
[CAS# 88351-59-1]

Identification

• Name: Methyl N-{3-acetamido-4-[(2-cyano-4,6-dinitrophenyl)diazenyl]phenyl}-N-ethyl-beta-alaninate
• Synonyms: methyl N-[3-(acetylamino)-4-[(2-cyano-4,6-dinitrophenyl)azo]phenyl]-N-ethyl-β-alaninate
• Molecular Formula: C₂₁H₂₁N₇O₇
• Molecular Weight: 483.43
• CAS Registry Number: 88351-59-1
• EINECS: 289-406-9
• SMILES: COC(=O)CCN(CC)c2ccc(N=Nc1c(cc(cc1C#N)[N+]([O-])=O)[N+]([O-])=O)c(NC(C)=O)c2
• InChI: 1S/C21H21N7O7/c1-4-26(8-7-20(30)35-3)15-5-6-17(18(10-15)23-13(2)29)24-25-21-14(12-22)9-16(27(31)32)11-19(21)28(33)34/h5-6,9-11H,4,7-8H2,1-3H3,(H,23,29)
• InChIKey: BCEWNCRIZVBZGZ-UHFFFAOYSA-N

Properties

• Density: 1.405g/cm³ (Cal.)
• Boiling point: 750.975°C at 760 mmHg (Cal.)
• Flash point: 407.975°C (Cal.)