2-Azabicyclo[4.2.0]Octa-1,3,5-Trien-7-One
[CAS# 169229-08-7]

Identification

• Name: 2-Azabicyclo[4.2.0]Octa-1,3,5-Trien-7-One
• Synonyms: 2-AZABICYCLO[4.2.0]OCTA-1,3,5-TRIEN-7-ONE
• Molecular Formula: C₇H₅NO
• Molecular Weight: 119.12
• CAS Registry Number: 169229-08-7
• SMILES: c1cc2c(nc1)CC2=O
• InChI: 1S/C7H5NO/c9-7-4-6-5(7)2-1-3-8-6/h1-3H,4H2
• InChIKey: MSLQOIWUDSFHFU-UHFFFAOYSA-N

Properties

• Density: 1.316g/cm³ (Cal.)
• Boiling point: 238.404°C at 760 mmHg (Cal.)
• Flash point: 103.92°C (Cal.)
• Refractive index: 1.626 (Cal.)