9-Oxa-3,6,10-Triazatricyclo[6.2.1.0^2,6]Undeca-1(10),2,4,7-Tetraene
[CAS# 474884-44-1]

Identification

• Name: 9-Oxa-3,6,10-Triazatricyclo[6.2.1.0^2,6]Undeca-1(10),2,4,7-Tetraene
• Synonyms: 6,9-methanoimidazo[2,1-d][1,2,5]oxadiazepine
• Molecular Formula: C₇H₅N₃O
• Molecular Weight: 147.13
• CAS Registry Number: 474884-44-1
• SMILES: c1cn2c(n1)C3=NOC(=C2)C3
• InChI: 1S/C7H5N3O/c1-2-10-4-5-3-6(9-11-5)7(10)8-1/h1-2,4H,3H2
• InChIKey: HQBKQOCULQMAIZ-UHFFFAOYSA-N

Properties

• Density: 1.705g/cm³ (Cal.)
• Boiling point: 434.36°C at 760 mmHg (Cal.)
• Flash point: 216.494°C (Cal.)
• Refractive index: 1.852 (Cal.)