3-Oxa-4,10-diazatetracyclo[5.4.1.0^2,6.0^8,11]dodeca-1,4,6,8,10-pentaene
[CAS# 70729-53-2]

Identification

• Name: 3-Oxa-4,10-diazatetracyclo[5.4.1.0^2,6.0^8,11]dodeca-1,4,6,8,10-pentaene
• Synonyms: 4,7-methanoazeto[2',3':4,5]benzo[1,2-d]isoxazole
• Molecular Formula: C₉H₄N₂O
• Molecular Weight: 156.14
• CAS Registry Number: 70729-53-2
• SMILES: C1C2=C3C=NOC3=C1C4=NC=C24
• InChI: 1S/C9H4N2O/c1-4-6-2-10-8(6)5(1)9-7(4)3-11-12-9/h2-3H,1H2
• InChIKey: OPRBKWDCIIPSET-UHFFFAOYSA-N

Properties

• Density: 2.0±0.1g/cm³ (Cal.)
• Boiling point: 285.4±50.0°C at 760 mmHg (Cal.)
• Flash point: 104.4±22.6°C (Cal.)