5-Methoxy-1H-Benzimidazole-2-Carbonitrile 1-Oxide
[CAS# 104512-94-9]

Identification

• Name: 5-Methoxy-1H-Benzimidazole-2-Carbonitrile 1-Oxide
• Synonyms: 2-cyano-5-methoxy-1H-benzo[d]imidazole 1-oxide
• Molecular Formula: C₉H₇N₃O₂
• Molecular Weight: 189.17
• CAS Registry Number: 104512-94-9
• SMILES: COc1ccc2c(c1)N=C([NH+]2[O-])C#N
• InChI: 1S/C9H7N3O2/c1-14-6-2-3-8-7(4-6)11-9(5-10)12(8)13/h2-4,12H,1H3
• InChIKey: WZNPLYACIRKHBW-UHFFFAOYSA-N

Properties

• Density: 1.395g/cm³ (Cal.)
• Refractive index: 1.657 (Cal.)