2-Methyl-5-Nitro-1H-Benzimidazole 3-Oxide
[CAS# 4615-69-4]

Identification

• Name: 2-Methyl-5-Nitro-1H-Benzimidazole 3-Oxide
• Synonyms: 1-Hydroxy-2-Methyl-6-Nitro-Benzimidazole; Nsc116844
• Molecular Formula: C₈H₇N₃O₃
• Molecular Weight: 193.16
• CAS Registry Number: 4615-69-4
• SMILES: C2=C1[N](O)C(=NC1=CC=C2[N+]([O-])=O)C
• InChI: 1S/C8H7N3O3/c1-5-9-7-3-2-6(11(13)14)4-8(7)10(5)12/h2-4,12H,1H3
• InChIKey: UWBNPKAUKQNJCM-UHFFFAOYSA-N

Properties

• Density: 1.588g/cm³ (Cal.)
• Boiling point: 458.255°C at 760 mmHg (Cal.)
• Flash point: 230.944°C (Cal.)