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CAS 799262-37-6

:

3-(5-methyl-1H-tetrazol-1-yl)benzoic acid

Description:
3-(5-Methyl-1H-tetrazol-1-yl)benzoic acid is an organic compound characterized by its tetrazole and benzoic acid functional groups. It features a benzoic acid moiety, which contributes to its acidity and potential for forming hydrogen bonds, and a 5-methyl-1H-tetrazole group, which enhances its biological activity and solubility properties. The presence of the tetrazole ring, a five-membered heterocyclic structure containing four nitrogen atoms, imparts unique chemical reactivity and potential pharmacological properties, making it of interest in medicinal chemistry. This compound is typically a solid at room temperature and may exhibit moderate to high solubility in polar solvents due to the presence of the carboxylic acid group. Its molecular structure allows for various interactions, including hydrogen bonding and π-π stacking, which can influence its behavior in biological systems and its utility in drug design. Overall, 3-(5-methyl-1H-tetrazol-1-yl)benzoic acid is a versatile compound with potential applications in pharmaceuticals and materials science.
Formula:C9H8N4O2
InChI:InChI=1/C9H8N4O2/c1-6-10-11-12-13(6)8-4-2-3-7(5-8)9(14)15/h2-5H,1H3,(H,14,15)
SMILES:Cc1nnnn1c1cccc(c1)C(=O)O
Synonyms:
  • benzoic acid, 3-(5-methyl-1H-tetrazol-1-yl)-
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