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CAS 331-33-9

:

ethyl [3-(trifluoromethyl)phenyl]acetate

Description:
Ethyl [3-(trifluoromethyl)phenyl]acetate, with the CAS number 331-33-9, is an organic compound that belongs to the class of esters. It is characterized by the presence of an ethyl group and an acetate functional group, along with a phenyl ring that is substituted at the meta position with a trifluoromethyl group. This trifluoromethyl substitution imparts unique electronic and steric properties, making the compound of interest in various chemical applications, including pharmaceuticals and agrochemicals. Ethyl [3-(trifluoromethyl)phenyl]acetate is typically a colorless to pale yellow liquid with a pleasant odor, and it is soluble in organic solvents. Its chemical structure contributes to its reactivity, allowing it to participate in various chemical reactions, such as nucleophilic substitutions and coupling reactions. Additionally, the trifluoromethyl group enhances the compound's lipophilicity and metabolic stability, which can be advantageous in drug design and development. Safety data should be consulted for handling and exposure guidelines, as with all chemical substances.
Formula:C11H11F3O2
InChI:InChI=1/C11H11F3O2/c1-2-16-10(15)7-8-4-3-5-9(6-8)11(12,13)14/h3-6H,2,7H2,1H3
SMILES:CCOC(=O)Cc1cccc(c1)C(F)(F)F
Synonyms:
  • Benzeneacetic acid, 3-(trifluoromethyl)-, ethyl ester
  • Ethyl [3-(trifluoromethyl)phenyl]acetate
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