7-Methyl-1H-Benzimidazole-2-Carbonitrile 3-Oxide
[CAS# 116059-19-9]

Identification

• Name: 7-Methyl-1H-Benzimidazole-2-Carbonitrile 3-Oxide
• Synonyms: 2-cyano-7-methyl-1H-benzo[d]imidazole 3-oxide
• Molecular Formula: C₉H₇N₃O
• Molecular Weight: 173.17
• CAS Registry Number: 116059-19-9
• SMILES: CC1=C2C(=CC=C1)[N+](=C(N2)C#N)[O-]
• InChI: 1S/C9H7N3O/c1-6-3-2-4-7-9(6)11-8(5-10)12(7)13/h2-4,11H,1H3
• InChIKey: KYSYUZMXJRAKEI-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 410.5±38.0°C at 760 mmHg (Cal.)
• Flash point: 202.1±26.8°C (Cal.)
• Refractive index: 1.675 (Cal.)