7-Phenyl-1,4-Diazabicyclo[4.1.0]Heptan-5-One
[CAS# 100059-96-9]

Identification

• Name: 7-Phenyl-1,4-Diazabicyclo[4.1.0]Heptan-5-One
• Synonyms: 1,4-Diazabicyclo[4.1.0]heptan-5-one, 7-phenyl-; 7-Phenyl-1,4-diazabicyclo[4.1.0]heptan-5-on; 7-Phenyl-1,4-diazabicyclo[4.1.0]heptan-5-one
• Molecular Formula: C₁₁H₁₂N₂O
• Molecular Weight: 188.23
• CAS Registry Number: 100059-96-9
• SMILES: c1ccc(cc1)C2C3N2CCNC3=O
• InChI: 1S/C11H12N2O/c14-11-10-9(13(10)7-6-12-11)8-4-2-1-3-5-8/h1-5,9-10H,6-7H2,(H,12,14)
• InChIKey: KMRTVBXHIUAWHI-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 392.6±42.0°C at 760 mmHg (Cal.)
• Flash point: 191.2±27.9°C (Cal.)
• Refractive index: 1.645 (Cal.)