559113

Ethyl (2-trifluoromethylbenzoyl)acetate

• Synonym(s): Ethyl 3-oxo-3-(2-trifluoromethylphenyl)propanoate
• Linear Formula: CF₃C₆H₄COCH₂CO₂C₂H₅
• CAS Number: 89424-17-9
• Molecular Weight: 260.21
• MDL number: MFCD03424820
• UNSPSC Code: 12352100
• PubChem Substance ID: 24879797
• NACRES: NA.22

Properties

• refractive index: n20/D 1.4875 (lit.)
• bp: 237-238 °C (lit.)
• density: 1.258 g/mL at 25 °C (lit.)
• SMILES string: CCOC(=O)CC(=O)c1ccccc1C(F)(F)F
• InChI: 1S/C12H11F3O3/c1-2-18-11(17)7-10(16)8-5-3-4-6-9(8)12(13,14)15/h3-6H,2,7H2,1H3
• InChI key: KMPAHDWULITWIH-UHFFFAOYSA-N

Safety Information

• Storage Class Code: 10 - Combustible liquids
• WGK: WGK 3
• Flash Point(F): Not applicable
• Flash Point(C): Not applicable
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, Gloves