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CAS 876718-01-3

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2-(1H-1,2,4-triazol-1-ylmethyl)benzoic acid

Description:
2-(1H-1,2,4-triazol-1-ylmethyl)benzoic acid is a chemical compound characterized by its unique structure, which includes a benzoic acid moiety and a triazole ring. This compound typically exhibits properties such as being a solid at room temperature, with potential solubility in polar solvents due to the presence of the carboxylic acid group. The triazole ring contributes to its potential biological activity, as triazoles are known for their role in pharmaceuticals, particularly as antifungal agents. The compound may also display acidic properties due to the carboxylic acid functional group, which can participate in hydrogen bonding and influence its reactivity and interactions with other molecules. Additionally, the presence of both aromatic and heterocyclic components in its structure may impart unique electronic properties, making it of interest in various fields, including medicinal chemistry and materials science. Overall, 2-(1H-1,2,4-triazol-1-ylmethyl)benzoic acid is a versatile compound with potential applications in drug development and other chemical research areas.
Formula:C10H9N3O2
InChI:InChI=1/C10H9N3O2/c14-10(15)9-4-2-1-3-8(9)5-13-7-11-6-12-13/h1-4,6-7H,5H2,(H,14,15)
SMILES:c1ccc(c(c1)Cn1cncn1)C(=O)O
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