5-(1-Methylethyl)-4-isoxazolecarboxylic acid

CAS Registry Number®

134541-05-2
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CAS Name

5-(1-Methylethyl)-4-isoxazolecarboxylic acid

Molecular Formula

C7H9NO3

Molecular Mass

155.15

Cite this Page

5-(1-Methylethyl)-4-isoxazolecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=134541-05-2 (retrieved 2024-05-04) (CAS RN: 134541-05-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    80-81 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C7H9NO3/c1-4(2)6-5(7(9)10)3-8-11-6/h3-4H,1-2H3,(H,9,10)

InChIKey

InChIKey=ICXLYLUGOXIJDS-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=C(C(C)C)ON=C1

Canonical SMILES

O=C(O)C=1C=NOC1C(C)C

Other Names for this Substance

  • 4-Isoxazolecarboxylic acid, 5-(1-methylethyl)-
  • 5-(1-Methylethyl)-4-isoxazolecarboxylic acid
  • 5-Isopropylisoxazole-4-carboxylic acid

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