N-(4-Cyano-2-Nitrophenyl)Acetamide
[CAS# 29289-18-7]

Identification

• Name: N-(4-Cyano-2-Nitrophenyl)Acetamide
• Synonyms: 4-Acetamido-3-nitrobenzonitrile; MFCD00724165; n / a
• Molecular Formula: C₉H₇N₃O₃
• Molecular Weight: 205.17
• CAS Registry Number: 29289-18-7
• SMILES: CC(=O)NC1=C(C=C(C=C1)C#N)[N+](=O)[O-]
• InChI: 1S/C9H7N3O3/c1-6(13)11-8-3-2-7(5-10)4-9(8)12(14)15/h2-4H,1H3,(H,11,13)
• InChIKey: HCEWKFAGNGVVBE-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Melting point: 124-127°C (Expl.)
• Boiling point: 436.5±40.0°C at 760 mmHg (Cal.)
• Flash point: 217.8±27.3°C (Cal.)
• Refractive index: 1.589 (Cal.)

Safety Data

• Safety Description: Irritant