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CAS 349-83-7

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2-[[3-(Trifluoromethyl)phenyl]thio]acetic acid

Description:
2-[[3-(Trifluoromethyl)phenyl]thio]acetic acid, with the CAS number 349-83-7, is an organic compound characterized by the presence of a trifluoromethyl group attached to a phenyl ring, which is further linked to a thioacetic acid moiety. This compound typically exhibits properties associated with both aromatic and sulfur-containing compounds, including potential reactivity due to the presence of the thiol group. The trifluoromethyl group contributes to its lipophilicity and can influence its biological activity, making it of interest in medicinal chemistry. The compound is likely to be a solid at room temperature and may have moderate solubility in organic solvents. Its chemical structure suggests potential applications in pharmaceuticals, agrochemicals, or as a reagent in organic synthesis. Additionally, the presence of the trifluoromethyl group can enhance the compound's stability and alter its electronic properties, which may be beneficial in various chemical reactions or applications. Safety and handling precautions should be observed due to the potential toxicity associated with fluorinated compounds.
Formula:C9H7F3O2S
InChI:InChI=1S/C9H7F3O2S/c10-9(11,12)6-2-1-3-7(4-6)15-5-8(13)14/h1-4H,5H2,(H,13,14)
InChI key:InChIKey=YBUZSRSMQIEFBR-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=CC(SCC(O)=O)=CC=C1
Synonyms:
  • 2-[[3-(Trifluoromethyl)phenyl]sulfanyl]acetic acid
  • 2-[[3-(Trifluoromethyl)phenyl]thio]acetic acid
  • Acetic acid, 2-[[3-(trifluoromethyl)phenyl]thio]-
  • Acetic acid, [(α,α,α-trifluoro-m-tolyl)thio]-
  • Acetic acid, [[3-(trifluoromethyl)phenyl]thio]-
  • Trifluoromethylphenylthioaceticacid
  • [3-(Trifluoromethyl)phenylthio]acetic acid
  • {[3-(Trifluoromethyl)Phenyl]Sulfanyl}Acetate
  • {[3-(Trifluoromethyl)Phenyl]Sulfanyl}Acetic Acid
  • {[4-(Trifluoromethyl)Phenyl]Sulfanyl}Acetic Acid
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