4-[3-(4-Methylphenyl)propanoyl]benzonitrile
[CAS# 898768-57-5]

Identification

• Name: 4-[3-(4-Methylphenyl)propanoyl]benzonitrile
• Synonyms: 4'-cyano-3-(4-methylphenyl)propiophenone
• Molecular Formula: C₁₇H₁₅NO
• Molecular Weight: 249.31
• CAS Registry Number: 898768-57-5
• SMILES: N#Cc1ccc(cc1)C(=O)CCc2ccc(C)cc2
• InChI: 1S/C17H15NO/c1-13-2-4-14(5-3-13)8-11-17(19)16-9-6-15(12-18)7-10-16/h2-7,9-10H,8,11H2,1H3
• InChIKey: YLJADAJAHOTNPH-UHFFFAOYSA-N

Properties

• Density: 1.122g/cm³ (Cal.)
• Boiling point: 437.582°C at 760 mmHg (Cal.)
• Flash point: 218.442°C (Cal.)
• Refractive index: 1.586 (Cal.)