3-(4-Chlorophenyl)-5-isoxazolecarboxylic acid

CAS Registry Number®

338982-11-9

CAS Name

3-(4-Chlorophenyl)-5-isoxazolecarboxylic acid

Molecular Formula

C10H6ClNO3

Molecular Mass

223.61

Cite this Page

3-(4-Chlorophenyl)-5-isoxazolecarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=338982-11-9 (retrieved 2024-11-28) (CAS RN: 338982-11-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    185-186 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H6ClNO3/c11-7-3-1-6(2-4-7)8-5-9(10(13)14)15-12-8/h1-5H,(H,13,14)

InChIKey

InChIKey=COIATTMFFQMKKS-UHFFFAOYSA-N

SMILES

C(O)(=O)C1=CC(=NO1)C2=CC=C(Cl)C=C2

Canonical SMILES

O=C(O)C=1ON=C(C1)C=2C=CC(Cl)=CC2

Other Names for this Substance

  • 5-Isoxazolecarboxylic acid, 3-(4-chlorophenyl)-
  • 3-(4-Chlorophenyl)-5-isoxazolecarboxylic acid
  • 3-(4-Chlorophenyl)isoxazole-5-carboxylic acid

CAS INSIGHTSTM
Hourglass and a clock