3-(3-Phenylpropanoyl)benzonitrile
[CAS# 898764-08-4]

Identification

• Name: 3-(3-Phenylpropanoyl)benzonitrile
• Synonyms: 3'-cyano-3-phenylpropiophenone
• Molecular Formula: C₁₆H₁₃NO
• Molecular Weight: 235.28
• CAS Registry Number: 898764-08-4
• SMILES: N#Cc1cccc(c1)C(=O)CCc2ccccc2
• InChI: 1S/C16H13NO/c17-12-14-7-4-8-15(11-14)16(18)10-9-13-5-2-1-3-6-13/h1-8,11H,9-10H2
• InChIKey: IXURKHAXPCDSMF-UHFFFAOYSA-N

Properties

• Density: 1.14g/cm³ (Cal.)
• Boiling point: 418.709°C at 760 mmHg (Cal.)
• Flash point: 207.028°C (Cal.)
• Refractive index: 1.594 (Cal.)