Methyl (1R,2R,5S)-4-oxo-3,8-diazabicyclo[3.2.1]octane-2-carboxylate
[CAS# 676148-40-6]

Identification

• Name: Methyl (1R,2R,5S)-4-oxo-3,8-diazabicyclo[3.2.1]octane-2-carboxylate
• Synonyms: (1R,2R,5S)-methyl 4-oxo-3,8-diazabicyclo[3.2.1]octane-2-carboxylate
• Molecular Formula: C₈H₁₂N₂O₃
• Molecular Weight: 184.19
• CAS Registry Number: 676148-40-6
• SMILES: COC(=O)[C@H]1[C@H]2CC[C@H](N2)C(=O)N1
• InChI: 1S/C8H12N2O3/c1-13-8(12)6-4-2-3-5(9-4)7(11)10-6/h4-6,9H,2-3H2,1H3,(H,10,11)/t4-,5+,6-/m1/s1
• InChIKey: ZWFJMDRRIPFDQO-NGJCXOISSA-N

Properties

• Density: 1.235g/cm³ (Cal.)
• Boiling point: 380.208°C at 760 mmHg (Cal.)
• Flash point: 183.743°C (Cal.)
• Refractive index: 1.495 (Cal.)