3-Azabicyclo[4.2.0]Octa-1,3,5-Trien-7-One 3-Oxide
[CAS# 478619-41-9]

Identification

• Name: 3-Azabicyclo[4.2.0]Octa-1,3,5-Trien-7-One 3-Oxide
• Synonyms: 7-oxo-3-azabicyclo[4.2.0]octa-1,3,5-triene 3-oxide
• Molecular Formula: C₇H₅NO₂
• Molecular Weight: 135.12
• CAS Registry Number: 478619-41-9
• SMILES: c1c[n+](cc2c1C(=O)C2)[O-]
• InChI: 1S/C7H5NO2/c9-7-3-5-4-8(10)2-1-6(5)7/h1-2,4H,3H2
• InChIKey: JEZQQTAXJXHXAO-UHFFFAOYSA-N

Properties

• Density: 1.447g/cm³ (Cal.)
• Boiling point: 430.685°C at 760 mmHg (Cal.)
• Flash point: 214.271°C (Cal.)
• Refractive index: 1.682 (Cal.)