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CAS 175203-89-1

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3-(2-Thienyl)-5-(trifluoromethyl)isoxazole

Description:
3-(2-Thienyl)-5-(trifluoromethyl)isoxazole is a heterocyclic organic compound characterized by the presence of both isoxazole and thienyl groups. The isoxazole moiety consists of a five-membered ring containing three carbon atoms, one nitrogen atom, and one oxygen atom, while the thienyl group is derived from thiophene, incorporating a sulfur atom into its aromatic structure. The trifluoromethyl group (-CF3) is a notable feature that significantly influences the compound's electronic properties and lipophilicity, often enhancing its biological activity. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its unique structure allows for potential applications in pharmaceuticals, agrochemicals, and materials science, particularly in the development of compounds with specific biological activities or as intermediates in synthetic pathways. The presence of the trifluoromethyl group can also impart unique reactivity and stability characteristics, making it a subject of interest in various chemical research fields.
Formula:C8H4F3NOS
InChI:InChI=1S/C8H4F3NOS/c9-8(10,11)7-4-5(12-13-7)6-2-1-3-14-6/h1-4H
InChI key:InChIKey=TUQUPXBKYCKHTB-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=CC(=NO1)C2=CC=CS2
Synonyms:
  • 2-Methoxy-6-(2,2,2-Trifluoroethoxy)Benzonitrile
  • 3-Thiophen-2-yl-5-(trifluoromethyl)-1,2-oxazole
  • Isoxazole, 3-(2-thienyl)-5-(trifluoromethyl)-
  • 3-(2-Thienyl)-5-(trifluoromethyl)isoxazole
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