6-Fluoro-1H-Benzimidazole-2-Carbonitrile 3-Oxide
[CAS# 118807-64-0]

Identification

• Name: 6-Fluoro-1H-Benzimidazole-2-Carbonitrile 3-Oxide
• Synonyms: 2-cyano-6-fluoro-1H-benzo[d]imidazole 3-oxide
• Molecular Formula: C₈H₄FN₃O
• Molecular Weight: 177.14
• CAS Registry Number: 118807-64-0
• SMILES: C1=CC2=C(C=C1F)NC(=[N+]2[O-])C#N
• InChI: 1S/C8H4FN3O/c9-5-1-2-7-6(3-5)11-8(4-10)12(7)13/h1-3,11H
• InChIKey: SZVRJEGXXLLSEG-UHFFFAOYSA-N

Properties

• Density: 1.5±0.1g/cm³ (Cal.)
• Boiling point: 409.1±37.0°C at 760 mmHg (Cal.)
• Flash point: 201.2±26.5°C (Cal.)
• Refractive index: 1.677 (Cal.)