1H-[1,3]Diazepino[1,2-a]Benzimidazole
[CAS# 36579-72-3]

Identification

• Name: 1H-[1,3]Diazepino[1,2-a]Benzimidazole
• Synonyms: 1H-benzo[4,5]imidazo[1,2-a][1,3]diazepine
• Molecular Formula: C₁₁H₉N₃
• Molecular Weight: 183.21
• CAS Registry Number: 36579-72-3
• SMILES: c1ccc2c(c1)nc3n2C=CC=CN3
• InChI: 1S/C11H9N3/c1-2-6-10-9(5-1)13-11-12-7-3-4-8-14(10)11/h1-8H,(H,12,13)
• InChIKey: RDEVLHBTYUNHCR-UHFFFAOYSA-N

Properties

• Density: 1.27g/cm³ (Cal.)
• Boiling point: 475.97°C at 760 mmHg (Cal.)
• Flash point: 241.658°C (Cal.)