3-[3-(4-Fluorophenyl)propanoyl]benzonitrile
[CAS# 898767-98-1]

Identification

• Name: 3-[3-(4-Fluorophenyl)propanoyl]benzonitrile
• Synonyms: 3'-cyano-3-(4-fluorophenyl)propiophenone
• Molecular Formula: C₁₆H₁₂FNO
• Molecular Weight: 253.27
• CAS Registry Number: 898767-98-1
• SMILES: Fc2ccc(CCC(=O)c1cccc(C#N)c1)cc2
• InChI: 1S/C16H12FNO/c17-15-7-4-12(5-8-15)6-9-16(19)14-3-1-2-13(10-14)11-18/h1-5,7-8,10H,6,9H2
• InChIKey: GPYRNYXYTMJDBI-UHFFFAOYSA-N

Properties

• Density: 1.2g/cm³ (Cal.)
• Boiling point: 422.861°C at 760 mmHg (Cal.)
• Flash point: 209.539°C (Cal.)
• Refractive index: 1.579 (Cal.)