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CAS 78190-05-3

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4-(1H-tetrazol-1-yl)benzoic acid

Description:
4-(1H-tetrazol-1-yl)benzoic acid is an organic compound characterized by the presence of a benzoic acid moiety substituted with a tetrazole group. The tetrazole ring, a five-membered heterocyclic structure containing four nitrogen atoms, imparts unique properties to the compound, including potential biological activity and stability. This compound typically exhibits good solubility in polar solvents due to the presence of the carboxylic acid functional group, which can also participate in hydrogen bonding. The presence of both the aromatic ring and the tetrazole enhances its potential for interactions with biological targets, making it of interest in medicinal chemistry and drug design. Additionally, 4-(1H-tetrazol-1-yl)benzoic acid may exhibit acid-base properties, allowing it to act as a weak acid in solution. Its structural features suggest potential applications in pharmaceuticals, agrochemicals, and materials science, particularly in the development of novel compounds with specific biological or chemical activities.
Formula:C8H6N4O2
InChI:InChI=1/C8H6N4O2/c13-8(14)6-1-3-7(4-2-6)12-5-9-10-11-12/h1-5H,(H,13,14)
SMILES:c1cc(ccc1C(=O)O)n1cnnn1
Synonyms:
  • Benzoic acid, 4-(1H-tetrazol-1-yl)-
  • 4-(Tetrazol-1-Yl)Benzoic Acid
  • 4-(1H-Tetrazol-1-yl)benzoic acid
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