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

CAS Registry Number®

21080-81-9
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CAS Name

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

Molecular Formula

C9H11NO3

Molecular Mass

181.19

Cite this Page

3-Isoxazolecarboxylic acid, 5-cyclopropyl-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=21080-81-9 (retrieved 2024-08-12) (CAS RN: 21080-81-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C9H11NO3/c1-2-12-9(11)7-5-8(13-10-7)6-3-4-6/h5-6H,2-4H2,1H3

InChIKey

InChIKey=XMKHEATVFWAIMD-UHFFFAOYSA-N

SMILES

C(OCC)(=O)C=1C=C(ON1)C2CC2

Canonical SMILES

O=C(OCC)C1=NOC(=C1)C2CC2

Other Names for this Substance

  • 3-Isoxazolecarboxylic acid, 5-cyclopropyl-, ethyl ester
  • Ethyl 5-cyclopropylisoxazole-3-carboxylate
  • Ethyl 5-cyclopropylisoxazle-3-carboxylate