4-[2-(1-Azetidinylmethyl)benzoyl]benzonitrile
[CAS# 898754-50-2]

Identification

• Name: 4-[2-(1-Azetidinylmethyl)benzoyl]benzonitrile
• Synonyms: 2-azetidinomethyl-4'-cyanobenzophenone
• Molecular Formula: C₁₈H₁₆N₂O
• Molecular Weight: 276.33
• CAS Registry Number: 898754-50-2
• SMILES: N#Cc1ccc(cc1)C(=O)c3ccccc3CN2CCC2
• InChI: 1S/C18H16N2O/c19-12-14-6-8-15(9-7-14)18(21)17-5-2-1-4-16(17)13-20-10-3-11-20/h1-2,4-9H,3,10-11,13H2
• InChIKey: BFMURANZQUXRSV-UHFFFAOYSA-N

Properties

• Density: 1.222g/cm³ (Cal.)
• Boiling point: 473.36°C at 760 mmHg (Cal.)
• Flash point: 240.08°C (Cal.)
• Refractive index: 1.636 (Cal.)