4-Oxo-4-[4-(trifluoromethyl)phenyl]butanenitrile
[CAS# 898783-70-5]

Identification

• Name: 4-Oxo-4-[4-(trifluoromethyl)phenyl]butanenitrile
• Synonyms: 4-oxo-4-(4-trifluoromethylphenyl)butyronitrile
• Molecular Formula: C₁₁H₈F₃NO
• Molecular Weight: 227.18
• CAS Registry Number: 898783-70-5
• SMILES: FC(F)(F)c1ccc(cc1)C(=O)CCC#N
• InChI: 1S/C11H8F3NO/c12-11(13,14)9-5-3-8(4-6-9)10(16)2-1-7-15/h3-6H,1-2H2
• InChIKey: VCUOVUPYSQJDRV-UHFFFAOYSA-N

Properties

• Density: 1.256g/cm³ (Cal.)
• Boiling point: 344.579°C at 760 mmHg (Cal.)
• Flash point: 162.196°C (Cal.)
• Refractive index: 1.469 (Cal.)