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CAS 1803587-69-0

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3-Methyl-3-(1H-1,2,4-triazol-1-yl)-2-butanone

Description:
3-Methyl-3-(1H-1,2,4-triazol-1-yl)-2-butanone is an organic compound characterized by its unique structure, which includes a ketone functional group and a triazole ring. This compound features a butanone backbone with a methyl group and a triazole substituent, contributing to its potential biological activity. The presence of the triazole moiety suggests that it may exhibit properties relevant to pharmaceuticals, particularly in antifungal or antimicrobial applications, as triazoles are known for their role in inhibiting specific enzymes in pathogens. The compound is likely to be a colorless to pale yellow liquid or solid, depending on its purity and conditions. Its solubility may vary in different solvents, and it may exhibit moderate stability under standard conditions. As with many organic compounds, safety data should be consulted to understand its handling, toxicity, and environmental impact. Overall, 3-Methyl-3-(1H-1,2,4-triazol-1-yl)-2-butanone represents a compound of interest in both synthetic chemistry and potential therapeutic applications.
Formula:C7H11N3O
InChI:InChI=1S/C7H11N3O/c1-6(11)7(2,3)10-5-8-4-9-10/h4-5H,1-3H3
InChI key:InChIKey=HYIOOBSVQLUCSH-UHFFFAOYSA-N
SMILES:C(C(C)=O)(C)(C)N1C=NC=N1
Synonyms:
  • 2-Butanone, 3-methyl-3-(1H-1,2,4-triazol-1-yl)-
  • 3-Methyl-3-(1H-1,2,4-triazol-1-yl)-2-butanone
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