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CAS 89776-75-0

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5-Propyl-3-isoxazolecarboxylic acid

Description:
5-Propyl-3-isoxazolecarboxylic acid is an organic compound characterized by its isoxazole ring, which is a five-membered heterocyclic structure containing both nitrogen and oxygen atoms. This compound features a propyl group attached to the isoxazole ring, contributing to its hydrophobic properties. The carboxylic acid functional group (-COOH) is present at the 3-position of the isoxazole, imparting acidic characteristics and making it soluble in polar solvents. The presence of the isoxazole moiety suggests potential biological activity, as many isoxazole derivatives are known for their pharmacological properties. The compound's structure allows for various interactions, including hydrogen bonding and π-π stacking, which can influence its reactivity and interactions with biological targets. Additionally, the compound may be of interest in medicinal chemistry and agricultural applications due to its potential as a bioactive agent. Overall, 5-Propyl-3-isoxazolecarboxylic acid is a versatile compound with unique chemical properties that warrant further investigation for its applications in various fields.
Formula:C7H9NO3
InChI:InChI=1S/C7H9NO3/c1-2-3-5-4-6(7(9)10)8-11-5/h4H,2-3H2,1H3,(H,9,10)
InChI key:InChIKey=ZXWHSBZHRVKCGZ-UHFFFAOYSA-N
SMILES:C(O)(=O)C=1C=C(CCC)ON1
Synonyms:
  • 3-Isoxazolecarboxylic acid, 5-propyl-
  • 5-Propyl-3-isoxazolecarboxylic acid
  • 5-Propyl-3-isoxazolecarboxylicacid
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