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CAS 1261269-06-0

:

3-(1-Methyl-1H-imidazol-5-yl)benzoic acid

Description:
3-(1-Methyl-1H-imidazol-5-yl)benzoic acid, identified by its CAS number 1261269-06-0, is an organic compound characterized by the presence of both a benzoic acid moiety and a 1-methyl-1H-imidazole group. This compound features a carboxylic acid functional group (-COOH) attached to a benzene ring, which contributes to its acidity and potential for hydrogen bonding. The imidazole ring, a five-membered heterocyclic structure containing nitrogen, imparts unique electronic properties and can participate in various chemical interactions, including coordination with metal ions. The presence of the methyl group on the imidazole enhances its lipophilicity, potentially influencing its solubility and reactivity in biological systems. This compound may exhibit interesting pharmacological properties, making it a candidate for further research in medicinal chemistry. Its structural characteristics suggest potential applications in drug development, particularly in targeting specific biological pathways or as a building block for more complex molecules.
Formula:C11H10N2O2
InChI:InChI=1S/C11H10N2O2/c1-13-7-12-6-10(13)8-3-2-4-9(5-8)11(14)15/h2-7H,1H3,(H,14,15)
InChI key:InChIKey=CCTCZHDQSJKDGB-UHFFFAOYSA-N
SMILES:CN1C(C2=CC(C(O)=O)=CC=C2)=CN=C1
Synonyms:
  • 3-(1-Methyl-5-imidazolyl)benzoic acid
  • 3-(1-Methyl-1H-imidazol-5-yl)benzoic acid
  • Benzoic acid, 3-(1-methyl-1H-imidazol-5-yl)-
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