5-Isoxazolecarboxylic acid, 3-methyl-, methyl ester

CAS Registry Number®

1004-96-2
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CAS Name

5-Isoxazolecarboxylic acid, 3-methyl-, methyl ester

Molecular Formula

C6H7NO3

Molecular Mass

141.12

Cite this Page

5-Isoxazolecarboxylic acid, 3-methyl-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=1004-96-2 (retrieved 2024-04-29) (CAS RN: 1004-96-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    108 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C6H7NO3/c1-4-3-5(10-7-4)6(8)9-2/h3H,1-2H3

InChIKey

InChIKey=MBRNUSBFRMCWIZ-UHFFFAOYSA-N

SMILES

C(OC)(=O)C1=CC(C)=NO1

Canonical SMILES

O=C(OC)C=1ON=C(C1)C

Other Names for this Substance

  • 5-Isoxazolecarboxylic acid, 3-methyl-, methyl ester
  • 3-Methylisoxazole-5-carboxylic acid methyl ester
  • Methyl 3-methylisoxazole-5-carboxylate

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