3,5-Dimethyl-4-isoxazolepropanoic acid

CAS Registry Number®

116423-07-5
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CAS Name

3,5-Dimethyl-4-isoxazolepropanoic acid

Molecular Formula

C8H11NO3

Molecular Mass

169.18

Cite this Page

3,5-Dimethyl-4-isoxazolepropanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=116423-07-5 (retrieved 2024-04-25) (CAS RN: 116423-07-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H11NO3/c1-5-7(3-4-8(10)11)6(2)12-9-5/h3-4H2,1-2H3,(H,10,11)

InChIKey

InChIKey=KSKLKJYVYVPIFW-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 4-Isoxazolepropanoic acid, 3,5-dimethyl-
  • 3,5-Dimethyl-4-isoxazolepropanoic acid

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