559245

Ethyl (3-trifluoromethylbenzoyl)acetate

97%

• Synonym(s): 3-(3-Trifluoromethylphenyl)-3-oxo-propionic acid ethyl ester, Ethyl 2-(3-trifluoromethylbenzoyl)acetate, Ethyl 3-(3-trifluoromethylphenyl)-3-oxopropanoate
• Linear Formula: CF₃C₆H₄COCH₂CO₂C₂H₅
• CAS Number: 1717-42-6
• Molecular Weight: 260.21
• MDL number: MFCD03424819
• UNSPSC Code: 12352100
• PubChem Substance ID: 24879808
• NACRES: NA.22

Properties

• Assay: 97%
• form: liquid
• refractive index: n20/D 1.4850 (lit.)
• bp: 250-251 °C (lit.)
• density: 1.267 g/mL at 25 °C (lit.)
• SMILES string: CCOC(=O)CC(=O)c1cccc(c1)C(F)(F)F
• InChI: 1S/C12H11F3O3/c1-2-18-11(17)7-10(16)8-4-3-5-9(6-8)12(13,14)15/h3-6H,2,7H2,1H3
• InChI key: YCHPVUWFIZXXPI-UHFFFAOYSA-N

Description

Application

Reactant for:

• Preparation of pyrido[1,2-a]benzimidazoles as cytotoxic and antiplasmodial agent
• Preparation of diaryl-substituted pyrazoles as potent CCR2 receptor antagonists
• Acid-catalyzed addition/annulation reactions
• Cyclocondensation with diaminophenylpyrazole

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