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CAS 874784-12-0

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4-Methyl-5-phenyl-4H-1,2,4-triazole-3-sulfonic acid

Description:
4-Methyl-5-phenyl-4H-1,2,4-triazole-3-sulfonic acid 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 methyl group and a phenyl group, contributing to its unique chemical properties and potential applications. The sulfonic acid functional group enhances its solubility in water and increases its acidity, making it useful in various chemical reactions and applications, particularly in pharmaceuticals and agrochemicals. The presence of the triazole moiety suggests potential biological activity, as triazoles are known for their role in antifungal and antimicrobial agents. Additionally, the compound may exhibit interesting coordination chemistry due to the nitrogen atoms in the triazole ring, which can act as ligands in metal complexes. Overall, 4-Methyl-5-phenyl-4H-1,2,4-triazole-3-sulfonic acid is a versatile compound with significant implications in both synthetic and medicinal chemistry.
Formula:C9H9N3O3S
InChI:InChI=1S/C9H9N3O3S/c1-12-8(7-5-3-2-4-6-7)10-11-9(12)16(13,14)15/h2-6H,1H3,(H,13,14,15)
InChI key:InChIKey=JLHXPIOHZDOODW-UHFFFAOYSA-N
SMILES:CN1C(=NN=C1S(=O)(=O)O)C2=CC=CC=C2
Synonyms:
  • 4-Methyl-5-phenyl-4H-1,2,4-triazole-3-sulfonic acid
  • 4H-1,2,4-Triazole-3-sulfonic acid, 4-methyl-5-phenyl-
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