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CAS 148438-00-0

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Methyl 3-(trifluoromethoxy)benzoate

Description:
Methyl 3-(trifluoromethoxy)benzoate is an organic compound characterized by its ester functional group, which is derived from benzoic acid and methanol. The presence of the trifluoromethoxy group (-O-CF3) significantly influences its chemical properties, imparting high electronegativity and making the compound more lipophilic. This substitution can enhance its reactivity in various chemical reactions, particularly in nucleophilic substitutions and electrophilic aromatic substitutions. The trifluoromethoxy group also contributes to the compound's potential applications in pharmaceuticals and agrochemicals, as it may improve biological activity or solubility. Methyl 3-(trifluoromethoxy)benzoate is typically a colorless to pale yellow liquid or solid, depending on the temperature, and exhibits moderate volatility. Its molecular structure allows for various interactions, making it a subject of interest in synthetic organic chemistry. Safety data should be consulted for handling, as compounds with trifluoromethyl groups can exhibit unique toxicological profiles.
Formula:C9H7F3O3
InChI:InChI=1/C9H7F3O3/c1-14-8(13)6-3-2-4-7(5-6)15-9(10,11)12/h2-5H,1H3
SMILES:COC(=O)c1cccc(c1)OC(F)(F)F
Synonyms:
  • 3-(Trifluoromethoxy)benzoic acid methyl ester
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