5-Methyl-3-isoxazoleacetic acid

CAS Registry Number®

57612-87-0
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CAS Name

5-Methyl-3-isoxazoleacetic acid

Molecular Formula

C6H7NO3

Molecular Mass

141.12

Cite this Page

5-Methyl-3-isoxazoleacetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=57612-87-0 (retrieved 2024-08-08) (CAS RN: 57612-87-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    80-82 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C6H7NO3/c1-4-2-5(7-10-4)3-6(8)9/h2H,3H2,1H3,(H,8,9)

InChIKey

InChIKey=UNFVEYMEZRVVOB-UHFFFAOYSA-N

SMILES

C(C(O)=O)C=1C=C(C)ON1

Canonical SMILES

O=C(O)CC1=NOC(=C1)C

Other Names for this Substance

  • 3-Isoxazoleacetic acid, 5-methyl-
  • 5-Methyl-3-isoxazoleacetic acid
  • (5-Methylisoxazol-3-yl)acetic acid
  • 2-(5-Methylisoxazol-3-yl)acetic acid
  • (5-Methyl-1,2-oxazol-3-yl)acetic acid

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