3-Oxo-3-(2,4,5-Trifluorophenyl)Propanenitrile
[CAS# 142501-42-6]

Identification

• Name: 3-Oxo-3-(2,4,5-Trifluorophenyl)Propanenitrile
• Synonyms: 2,4,5-Trifluorobenzoylacetonitrile; MFCD02260821
• Molecular Formula: C₉H₄F₃NO
• Molecular Weight: 199.13
• CAS Registry Number: 142501-42-6
• SMILES: Fc1cc(C(=O)CC#N)c(F)cc1F
• InChI: 1S/C9H4F3NO/c10-6-4-8(12)7(11)3-5(6)9(14)1-2-13/h3-4H,1H2
• InChIKey: OXROCPTTWLHZCC-UHFFFAOYSA-N

Properties

• Density: 1.388g/cm³ (Cal.)
• Boiling point: 312.402°C at 760 mmHg (Cal.)
• Flash point: 142.736°C (Cal.)
• Refractive index: 1.48 (Cal.)

Safety Data

• Safety Description: IRRITANT, FLAMMABLE