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CAS 80240-40-0

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4-(4-Fluorophenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one

Description:
4-(4-Fluorophenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one is a chemical compound characterized by its triazole ring structure, which is a five-membered heterocyclic compound containing three nitrogen atoms. This substance features a fluorophenyl group, indicating the presence of a fluorine atom on a phenyl ring, which can influence its electronic properties and reactivity. The compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its structure suggests potential applications in pharmaceuticals, particularly as an antifungal or antimicrobial agent, due to the triazole moiety's known biological activity. The presence of the fluorine atom can enhance lipophilicity, potentially improving the compound's bioavailability. Additionally, the compound's stability and reactivity can be influenced by the substituents on the triazole ring and the phenyl group. As with many chemical substances, safety data should be consulted to understand its handling, toxicity, and environmental impact.
Formula:C8H6FN3O
InChI:InChI=1S/C8H6FN3O/c9-6-1-3-7(4-2-6)12-5-10-11-8(12)13/h1-5H,(H,11,13)
InChI key:InChIKey=JHPNUFYUIFSEPU-UHFFFAOYSA-N
SMILES:O=C1N(C=NN1)C2=CC=C(F)C=C2
Synonyms:
  • 4-(4-Fluorophenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
  • PRP899
  • 3H-1,2,4-Triazol-3-one, 4-(4-fluorophenyl)-2,4-dihydro-
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