N-Nitroaniline
[CAS# 645-55-6]

Identification

• Name: N-Nitroaniline
• Synonyms: Benzenamine, N-Nitro-; N-Nitroaniline [Forbidden]; Aniline, N-Nitro-
• Molecular Formula: C₆H₆N₂O₂
• Molecular Weight: 138.13
• CAS Registry Number: 645-55-6
• SMILES: C1=C(N[N+]([O-])=O)C=CC=C1
• InChI: 1S/C6H6N2O2/c9-8(10)7-6-4-2-1-3-5-6/h1-5,7H
• InChIKey: VBEGHXKAFSLLGE-UHFFFAOYSA-N

Properties

• Density: 1.313g/cm³ (Cal.)
• Boiling point: 247.719°C at 760 mmHg (Cal.)
• Flash point: 103.617°C (Cal.)

References

• (1): G. Couderc and J. Hulliger. Channel forming organic crystals: guest alignment and properties, Chem. Soc. Rev., 2010, 39, 1545.