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CAS 156276-22-1

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Methyl α-hydroxy-4-(trifluoromethyl)benzeneacetate

Description:
Methyl α-hydroxy-4-(trifluoromethyl)benzeneacetate, identified by its CAS number 156276-22-1, is an organic compound characterized by the presence of a trifluoromethyl group and an ester functional group. This compound features a benzene ring substituted with both a hydroxyl group and a trifluoromethyl group, which significantly influences its chemical properties, including polarity and reactivity. The presence of the α-hydroxy group suggests potential for hydrogen bonding, which can affect solubility in various solvents. The trifluoromethyl group is known for imparting unique electronic properties, enhancing lipophilicity, and influencing biological activity. Methyl esters, in general, are often used in organic synthesis and can serve as intermediates in the production of pharmaceuticals and agrochemicals. The compound's specific reactivity and applications would depend on its structural characteristics, making it of interest in both synthetic organic chemistry and medicinal chemistry. Safety data and handling precautions should be consulted, as with any chemical substance, to ensure proper laboratory practices.
Formula:C10H9F3O3
InChI:InChI=1S/C10H9F3O3/c1-16-9(15)8(14)6-2-4-7(5-3-6)10(11,12)13/h2-5,8,14H,1H3
InChI key:InChIKey=ANLYXIOQZYHUAE-UHFFFAOYSA-N
SMILES:C(C(OC)=O)(O)C1=CC=C(C(F)(F)F)C=C1
Synonyms:
  • Benzeneacetic acid, α-hydroxy-4-(trifluoromethyl)-, methyl ester
  • Methyl 4-trifluoromethylmandelate
  • Methyl DL-4-(trifluoromethyl)mandelate
  • 2-Hydroxy-2-[4-(trifluoromethyl)phenyl]acetic acid methyl ester
  • Methyl α-hydroxy-4-(trifluoromethyl)benzeneacetate
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