5-[4-(1-Methylethyl)phenyl]-3-isoxazolecarboxylic acid

CAS Registry Number®

33282-10-9
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CAS Name

5-[4-(1-Methylethyl)phenyl]-3-isoxazolecarboxylic acid

Molecular Formula

C13H13NO3

Molecular Mass

231.25

Cite this Page

5-[4-(1-Methylethyl)phenyl]-3-isoxazolecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=33282-10-9 (retrieved 2024-09-07) (CAS RN: 33282-10-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H13NO3/c1-8(2)9-3-5-10(6-4-9)12-7-11(13(15)16)14-17-12/h3-8H,1-2H3,(H,15,16)

InChIKey

InChIKey=UERITGBANMVLAF-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1C=C(ON1)C2=CC=C(C(C)C)C=C2

Canonical SMILES

O=C(O)C1=NOC(=C1)C=2C=CC(=CC2)C(C)C

Other Names for this Substance

  • 3-Isoxazolecarboxylic acid, 5-[4-(1-methylethyl)phenyl]-
  • 3-Isoxazolecarboxylic acid, 5-p-cumenyl-
  • 5-[4-(1-Methylethyl)phenyl]-3-isoxazolecarboxylic acid