5,6-Dimethyl-4-Nitro-1H-Benzimidazole
[CAS# 21472-08-2]

Identification

• Name: 5,6-Dimethyl-4-Nitro-1H-Benzimidazole
• Synonyms: 5,6-dimethyl-4-nitro-1H-1,3-benzimidazole; 5,6-dimethyl-4-nitro-1H-benzo[d]imidazole; 5,6-Dimethyl-7-nitro-1H-benzoimidazole
• Molecular Formula: C₉H₉N₃O₂
• Molecular Weight: 191.19
• CAS Registry Number: 21472-08-2
• SMILES: CC1=CC2=C(C(=C1C)[N+](=O)[O-])N=CN2
• InChI: 1S/C9H9N3O2/c1-5-3-7-8(11-4-10-7)9(6(5)2)12(13)14/h3-4H,1-2H3,(H,10,11)
• InChIKey: YOCFPELJWAVPDL-UHFFFAOYSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Melting point: 236-237°C (Expl.)
• Boiling point: 475.1±40.0°C at 760 mmHg (Cal.)
• Flash point: 241.1±27.3°C (Cal.)
• Refractive index: 1.682 (Cal.)