4-[3-(1-Azetidinylmethyl)benzoyl]benzonitrile
[CAS# 898771-42-1]

Identification

• Name: 4-[3-(1-Azetidinylmethyl)benzoyl]benzonitrile
• Synonyms: 3-azetidinomethyl-4'-cyanobenzophenone
• Molecular Formula: C₁₈H₁₆N₂O
• Molecular Weight: 276.33
• CAS Registry Number: 898771-42-1
• SMILES: N#Cc1ccc(cc1)C(=O)c2cccc(c2)CN3CCC3
• InChI: 1S/C18H16N2O/c19-12-14-5-7-16(8-6-14)18(21)17-4-1-3-15(11-17)13-20-9-2-10-20/h1,3-8,11H,2,9-10,13H2
• InChIKey: ONKYTWFBAYDGIM-UHFFFAOYSA-N

Properties

• Density: 1.222g/cm³ (Cal.)
• Boiling point: 455.781°C at 760 mmHg (Cal.)
• Flash point: 229.448°C (Cal.)
• Refractive index: 1.636 (Cal.)