3H-[1,2,4]Triazepino[2,3-a]Benzimidazol-4(5H)-One
[CAS# 138824-80-3]

Identification

• Name: 3H-[1,2,4]Triazepino[2,3-a]Benzimidazol-4(5H)-One
• Synonyms: 3H-benzo[4,5]imidazo[1,2-b][1,2,4]triazepin-4(5H)-one
• Molecular Formula: C₁₀H₈N₄O
• Molecular Weight: 200.20
• CAS Registry Number: 138824-80-3
• SMILES: c1ccc2c(c1)nc3n2N=CCC(=O)N3
• InChI: 1S/C10H8N4O/c15-9-5-6-11-14-8-4-2-1-3-7(8)12-10(14)13-9/h1-4,6H,5H2,(H,12,13,15)
• InChIKey: DTTXEYQESNOYTA-UHFFFAOYSA-N

Properties

• Density: 1.537g/cm³ (Cal.)
• Refractive index: 1.786 (Cal.)