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CAS 264264-33-7

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3-(1H-Pyrazol-1-yl)benzoic acid

Description:
3-(1H-Pyrazol-1-yl)benzoic acid is an organic compound characterized by the presence of a pyrazole ring and a benzoic acid moiety. It features a pyrazole group, which is a five-membered ring containing two adjacent nitrogen atoms, attached to the meta position of a benzoic acid structure. This compound is typically a white to off-white solid and is soluble in polar organic solvents. Its molecular structure allows for potential hydrogen bonding due to the carboxylic acid functional group, which can influence its reactivity and interactions in various chemical environments. The compound may exhibit biological activity, making it of interest in pharmaceutical research. Additionally, its unique structure can facilitate coordination with metal ions, which is relevant in coordination chemistry. Overall, 3-(1H-Pyrazol-1-yl)benzoic acid is a versatile compound with applications in medicinal chemistry and materials science.
Formula:C10H8N2O2
InChI:InChI=1S/C10H8N2O2/c13-10(14)8-3-1-4-9(7-8)12-6-2-5-11-12/h1-7H,(H,13,14)
InChI key:InChIKey=KLMWJDGRIJPPSS-UHFFFAOYSA-N
SMILES:C(O)(=O)C=1C=C(C=CC1)N2C=CC=N2
Synonyms:
  • 3-Pyrazol-1-yl-benzoic acid
  • 3-Pyrazol-1-ylbenzoic acid
  • benzoic acid, 3-(1H-pyrazol-1-yl)-
  • 3-(1H-Pyrazol-1-yl)benzoic acid
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