Benzyl 2-oxa-3-azabicyclo[2.2.1]hept-5-ene-3-carboxylate
[CAS# 99027-88-0]

Identification

• Name: Benzyl 2-oxa-3-azabicyclo[2.2.1]hept-5-ene-3-carboxylate
• Synonyms: (1S,4R)-benzyl 2-oxa-3-azabicyclo[2.2.1]hept-5-ene-3-carboxylate; benzyl 3-oxa-2-aza-bicyclo[2.2.1]hept-5-ene-2-carboxylate
• Molecular Formula: C₁₃H₁₃NO₃
• Molecular Weight: 231.25
• CAS Registry Number: 99027-88-0
• SMILES: c1ccc(cc1)COC(=O)N2C3CC(O2)C=C3
• InChI: 1S/C13H13NO3/c15-13(14-11-6-7-12(8-11)17-14)16-9-10-4-2-1-3-5-10/h1-7,11-12H,8-9H2
• InChIKey: MXHWWBNEOOVFRU-UHFFFAOYSA-N

Properties

• Density: 1.292g/cm³ (Cal.)
• Boiling point: 357.416°C at 760 mmHg (Cal.)
• Flash point: 169.959°C (Cal.)