4,5-Dihydro-3-[4-(1-methylethyl)phenyl]-5-isoxazolecarboxylic acid

CAS Registry Number®

886967-70-0
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CAS Name

4,5-Dihydro-3-[4-(1-methylethyl)phenyl]-5-isoxazolecarboxylic acid

Molecular Formula

C13H15NO3

Molecular Mass

233.26

Cite this Page

4,5-Dihydro-3-[4-(1-methylethyl)phenyl]-5-isoxazolecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=886967-70-0 (retrieved 2024-08-18) (CAS RN: 886967-70-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H15NO3/c1-8(2)9-3-5-10(6-4-9)11-7-12(13(15)16)17-14-11/h3-6,8,12H,7H2,1-2H3,(H,15,16)

InChIKey

InChIKey=ZJWKFUQHRGKTOA-UHFFFAOYSA-N

SMILES

C(O)(=O)C1CC(=NO1)C2=CC=C(C(C)C)C=C2

Canonical SMILES

O=C(O)C1ON=C(C=2C=CC(=CC2)C(C)C)C1

Other Names for this Substance

  • 5-Isoxazolecarboxylic acid, 4,5-dihydro-3-[4-(1-methylethyl)phenyl]-
  • 4,5-Dihydro-3-[4-(1-methylethyl)phenyl]-5-isoxazolecarboxylic acid