5-Chloro-1H-Benzimidazole-2-Carbonitrile 3-Oxide
[CAS# 118807-86-6]

Identification

• Name: 5-Chloro-1H-Benzimidazole-2-Carbonitrile 3-Oxide
• Synonyms: 5-chloro-2-cyano-1H-benzo[d]imidazole 3-oxide
• Molecular Formula: C₈H₄ClN₃O
• Molecular Weight: 193.59
• CAS Registry Number: 118807-86-6
• SMILES: C1=CC2=C(C=C1Cl)[N+](=C(N2)C#N)[O-]
• InChI: 1S/C8H4ClN3O/c9-5-1-2-6-7(3-5)12(13)8(4-10)11-6/h1-3,11H
• InChIKey: JGCSNHXTQDHHJV-UHFFFAOYSA-N

Properties

• Density: 1.6±0.1g/cm³ (Cal.)
• Boiling point: 437.2±37.0°C at 760 mmHg (Cal.)
• Flash point: 218.2±26.5°C (Cal.)
• Refractive index: 1.721 (Cal.)