3-Oxa-4,8-Diazatricyclo[5.2.2.0^2,6]Undeca-1,4,6,8-Tetraene
[CAS# 132804-40-1]

Identification

• Name: 3-Oxa-4,8-Diazatricyclo[5.2.2.0^2,6]Undeca-1,4,6,8-Tetraene
• Synonyms: 5,6-dihydro-4,7-(azenometheno)benzo[d]isoxazole
• Molecular Formula: C₈H₆N₂O
• Molecular Weight: 146.15
• CAS Registry Number: 132804-40-1
• SMILES: c1c2c3c(cno3)c(n1)CC2
• InChI: 1S/C8H6N2O/c1-2-7-6-4-10-11-8(6)5(1)3-9-7/h3-4H,1-2H2
• InChIKey: MPVHMBVVPIKZBO-UHFFFAOYSA-N

Properties

• Density: 1.403g/cm³ (Cal.)
• Boiling point: 287.2°C at 760 mmHg (Cal.)
• Flash point: 138.103°C (Cal.)
• Refractive index: 1.697 (Cal.)