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CAS 113678-92-5

:

3-trifluoromethylcatechol

Description:
3-Trifluoromethylcatechol, with the CAS number 113678-92-5, is a chemical compound characterized by the presence of a catechol structure, which consists of a benzene ring with two hydroxyl (-OH) groups in the ortho position. The distinguishing feature of this compound is the trifluoromethyl group (-CF3) attached to the aromatic ring, specifically at the 3-position relative to the hydroxyl groups. This trifluoromethyl substitution significantly influences the compound's chemical properties, including its reactivity and polarity. 3-Trifluoromethylcatechol is typically a solid at room temperature and exhibits moderate solubility in organic solvents. The presence of both the catechol and trifluoromethyl groups can enhance its potential applications in various fields, including pharmaceuticals and agrochemicals, due to the unique electronic and steric effects imparted by the trifluoromethyl group. Additionally, the compound may exhibit interesting biological activities, making it a subject of interest in medicinal chemistry research.
Formula:C7H5F3O2
InChI:InChI=1/C7H5F3O2/c8-7(9,10)4-2-1-3-5(11)6(4)12/h1-3,11-12H
SMILES:c1cc(c(c(c1)O)O)C(F)(F)F
Synonyms:
  • 3-Tfm-catechol
  • 1,2-Benzenediol, 3-(trifluoromethyl)-
  • 3-(Trifluoromethyl)Benzene-1,2-Diol
  • 3-Trifluoromethylcatechol
  • 3-(Trifluoromethyl)-1,2-benzenediol
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