2-[3-(1-Azetidinylmethyl)benzoyl]benzonitrile
[CAS# 898771-36-3]

Identification

• Name: 2-[3-(1-Azetidinylmethyl)benzoyl]benzonitrile
• Synonyms: 3'-azetidinomethyl-2-cyanobenzophenone
• Molecular Formula: C₁₈H₁₆N₂O
• Molecular Weight: 276.33
• CAS Registry Number: 898771-36-3
• SMILES: N#Cc1ccccc1C(=O)c2cccc(c2)CN3CCC3
• InChI: 1S/C18H16N2O/c19-12-16-6-1-2-8-17(16)18(21)15-7-3-5-14(11-15)13-20-9-4-10-20/h1-3,5-8,11H,4,9-10,13H2
• InChIKey: VBECEPWTMYZXDD-UHFFFAOYSA-N

Properties

• Density: 1.222g/cm³ (Cal.)
• Boiling point: 480.973°C at 760 mmHg (Cal.)
• Flash point: 244.684°C (Cal.)
• Refractive index: 1.636 (Cal.)