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CAS 773873-69-1

:

methyl 3-fluoro-5-(trifluoromethyl)benzoate

Description:
Methyl 3-fluoro-5-(trifluoromethyl)benzoate, with the CAS number 773873-69-1, is an aromatic ester characterized by the presence of a methyl ester functional group attached to a benzene ring that has both a fluorine atom and a trifluoromethyl group as substituents. This compound typically exhibits a high degree of lipophilicity due to the presence of the trifluoromethyl group, which can enhance its biological activity and influence its solubility in organic solvents. The fluorine substituents can also impart unique electronic properties, potentially affecting reactivity and stability. Methyl 3-fluoro-5-(trifluoromethyl)benzoate may be utilized in various applications, including pharmaceuticals and agrochemicals, due to its potential as an intermediate in synthetic pathways. Its physical properties, such as boiling point and melting point, would be influenced by the molecular structure and the presence of fluorine atoms, which typically increase the compound's stability and alter its interaction with other molecules. Safety and handling precautions should be observed, as with many fluorinated compounds, due to potential toxicity and environmental impact.
Formula:C9H6F4O2
InChI:InChI=1/C9H6F4O2/c1-15-8(14)5-2-6(9(11,12)13)4-7(10)3-5/h2-4H,1H3
SMILES:COC(=O)c1cc(cc(c1)F)C(F)(F)F
Synonyms:
  • Benzoic Acid, 3-Fluoro-5-(Trifluoromethyl)-, Methyl Ester
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