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CAS 100047-54-9

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4-Isoxazolecarboxylic acid, 5-methyl-, methyl ester

Description:
4-Isoxazolecarboxylic acid, 5-methyl-, methyl ester, with the CAS number 100047-54-9, is an organic compound characterized by its isoxazole ring structure, which is a five-membered heterocyclic compound containing both nitrogen and oxygen atoms. This substance features a carboxylic acid functional group that is esterified with methanol, resulting in a methyl ester. The presence of a methyl group at the 5-position of the isoxazole ring contributes to its unique chemical properties. Typically, compounds like this exhibit moderate polarity due to the functional groups, which can influence their solubility in various solvents. They may also demonstrate biological activity, making them of interest in pharmaceutical research. The compound's stability, reactivity, and potential applications can vary based on its molecular structure and substituents. Overall, 4-Isoxazolecarboxylic acid, 5-methyl-, methyl ester is a notable compound in organic chemistry, particularly in the context of synthetic applications and medicinal chemistry.
Formula:C6H7NO3
InChI:InChI=1S/C6H7NO3/c1-4-5(3-7-10-4)6(8)9-2/h3H,1-2H3
InChI key:InChIKey=AHLBUWIGURZNRZ-UHFFFAOYSA-N
SMILES:C(OC)(=O)C1=C(C)ON=C1
Synonyms:
  • 4-Isoxazolecarboxylic acid, 5-methyl-, methyl ester
  • 4-Isoxazolecarboxylicacid,5-methyl-,methyl ester-
  • 5-Methylisoxazole-4-carboxylic acid methyl ester
  • Methyl 5-Methylisoxazole-4-Carboxylate
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