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CAS 21080-81-9

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3-Isoxazolecarboxylic acid, 5-cyclopropyl-, ethyl ester

Description:
3-Isoxazolecarboxylic acid, 5-cyclopropyl-, ethyl ester, identified by CAS number 21080-81-9, is an organic compound characterized by its isoxazole ring structure, which is a five-membered heterocyclic compound containing both nitrogen and oxygen atoms. This compound features a carboxylic acid functional group and an ethyl ester moiety, contributing to its chemical reactivity and potential applications in various fields, including pharmaceuticals and agrochemicals. The presence of the cyclopropyl group enhances its structural complexity and may influence its biological activity. Typically, compounds of this nature exhibit moderate to high polarity due to the presence of polar functional groups, which can affect their solubility in different solvents. Additionally, the isoxazole ring can participate in various chemical reactions, making it a versatile building block in synthetic organic chemistry. Overall, 3-Isoxazolecarboxylic acid, 5-cyclopropyl-, ethyl ester is of interest for its potential applications and unique structural features.
Formula:C9H11NO3
InChI:InChI=1S/C9H11NO3/c1-2-12-9(11)7-5-8(13-10-7)6-3-4-6/h5-6H,2-4H2,1H3
InChI key:InChIKey=XMKHEATVFWAIMD-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C=1C=C(ON1)C2CC2
Synonyms:
  • Ethyl 5-cyclopropylisoxazole-3-carboxylate
  • 3-Isoxazolecarboxylic acid, 5-cyclopropyl-, ethyl ester
  • Ethyl 5-cyclopropylisoxazle-3-carboxylate
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