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CAS 254895-42-6

:

α,α-Dimethyl-3-(trifluoromethyl)benzeneacetic acid

Description:
α,α-Dimethyl-3-(trifluoromethyl)benzeneacetic acid, with the CAS number 254895-42-6, is an organic compound characterized by its unique structure that includes a benzene ring substituted with both a trifluoromethyl group and a dimethyl group, along with a carboxylic acid functional group. This compound is typically a white to off-white solid at room temperature and is known for its relatively low solubility in water, while being more soluble in organic solvents. The presence of the trifluoromethyl group imparts significant lipophilicity and can influence the compound's reactivity and biological activity. The carboxylic acid group contributes to its acidity and potential for forming salts or esters. This compound may be of interest in various fields, including pharmaceuticals and agrochemicals, due to its potential biological activity and the role of fluorinated compounds in enhancing the properties of organic molecules. Safety data should be consulted for handling and storage, as with any chemical substance.
Formula:C11H11F3O2
InChI:InChI=1S/C11H11F3O2/c1-10(2,9(15)16)7-4-3-5-8(6-7)11(12,13)14/h3-6H,1-2H3,(H,15,16)
InChI key:InChIKey=XJOFPJZWSSQZMN-UHFFFAOYSA-N
SMILES:C(C(O)=O)(C)(C)C1=CC(C(F)(F)F)=CC=C1
Synonyms:
  • Benzeneacetic acid, α,α-dimethyl-3-(trifluoromethyl)-
  • 2-Methyl-2-[3-(trifluoromethyl)phenyl]propanoic acid
  • α,α-Dimethyl-3-(trifluoromethyl)benzeneacetic acid
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