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CAS 160388-54-5

:

4-(1H-1,2,4-TRIAZOL-1-YLMETHYL)BENZOIC ACID

Description:
4-(1H-1,2,4-Triazol-1-ylmethyl)benzoic acid, with the CAS number 160388-54-5, is an organic compound characterized by its triazole and benzoic acid functional groups. This compound features a triazole ring, which is a five-membered heterocyclic structure containing three nitrogen atoms, contributing to its potential biological activity and ability to form hydrogen bonds. The benzoic acid moiety provides acidic properties due to the carboxylic acid group, which can participate in various chemical reactions, including esterification and amidation. The presence of the triazole group may enhance the compound's solubility in polar solvents and its reactivity in coordination chemistry. Additionally, this compound may exhibit pharmacological properties, making it of interest in medicinal chemistry. Its structural characteristics suggest potential applications in drug development, particularly in the design of antifungal or antibacterial agents. Overall, 4-(1H-1,2,4-triazol-1-ylmethyl)benzoic acid is a versatile compound with significant implications in both synthetic and medicinal chemistry.
Formula:C10H9N3O2
InChI:InChI=1/C10H9N3O2/c14-10(15)9-3-1-8(2-4-9)5-13-7-11-6-12-13/h1-4,6-7H,5H2,(H,14,15)
InChI key:InChIKey=DJXUEFGFCMIONN-UHFFFAOYSA-N
SMILES:C(C1=CC=C(C(O)=O)C=C1)N2C=NC=N2
Synonyms:
  • 4-[1,2,4]Triazol-1-Ylmethyl-Benzoic Acid
  • Benzoic acid, 4-(1H-1,2,4-triazol-1-ylmethyl)-
  • 4-(1H-1,2,4-Triazol-1-ylmethyl)benzoic acid
  • 4-(1H-1,2,4-triazol-1-ylmethyl)benzoic acid hydrochloride
  • 4-(1H-1,2,4-TRIAZOL-1-YLMETHYL)BENZOIC ACID（WS204223）
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