5-Methyl-3-(4-methylphenyl)-4-isoxazolecarboxylic acid

CAS Registry Number®

91569-59-4
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CAS Name

5-Methyl-3-(4-methylphenyl)-4-isoxazolecarboxylic acid

Molecular Formula

C12H11NO3

Molecular Mass

217.22

Cite this Page

5-Methyl-3-(4-methylphenyl)-4-isoxazolecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=91569-59-4 (retrieved 2024-06-26) (CAS RN: 91569-59-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H11NO3/c1-7-3-5-9(6-4-7)11-10(12(14)15)8(2)16-13-11/h3-6H,1-2H3,(H,14,15)

InChIKey

InChIKey=IAGFERXYANTCJG-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C(=NOC1C)C2=CC=C(C)C=C2

Canonical SMILES

O=C(O)C=1C(=NOC1C)C=2C=CC(=CC2)C

Other Names for this Substance

  • 4-Isoxazolecarboxylic acid, 5-methyl-3-(4-methylphenyl)-
  • 4-Isoxazolecarboxylic acid, 5-methyl-3-p-tolyl-
  • 5-Methyl-3-(4-methylphenyl)-4-isoxazolecarboxylic acid