7-Bromo-2,4,9-Triazabicyclo[4.3.0]Nona-3,7,10-Trien-5-One
[CAS# 22276-97-7]

Identification

• Name: 7-Bromo-2,4,9-Triazabicyclo[4.3.0]Nona-3,7,10-Trien-5-One
• Synonyms: Nsc124163
• Molecular Formula: C₆H₄BrN₃O
• Molecular Weight: 214.02
• CAS Registry Number: 22276-97-7
• SMILES: C1=C(Br)C2=C([NH]1)NC=NC2=O
• InChI: 1S/C6H4BrN3O/c7-3-1-8-5-4(3)6(11)10-2-9-5/h1-2H,(H2,8,9,10,11)
• InChIKey: XJUAXRSIRZNYBE-UHFFFAOYSA-N

Properties

• Density: 2.23g/cm³ (Cal.)
• Boiling point: 462.652°C at 760 mmHg (Cal.)
• Flash point: 233.604°C (Cal.)