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Substance Name: 3-Isoxazolecarboxylic acid, 5-methyl-, 2,6-dimethylphenyl ester
RN: 145441-06-1
InChIKey: WGUSIUPNBKYKKP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H13-N-O3

Molecular Weight

  • 231.2497
 
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Names and Synonyms

Synonyms

  • 2,6-Dimethylphenyl 5-methyl-3-isoxazolecarboxylate
  • BRN 5815357

Systematic Name

  • 3-Isoxazolecarboxylic acid, 5-methyl-, 2,6-dimethylphenyl ester

Registry Numbers

CAS Registry Number

  • 145441-06-1

System Generated Number

  • 0145441061

Structure Descriptors

InChI

1S/C13H13NO3/c1-8-5-4-6-9(2)12(8)16-13(15)11-7-10(3)17-14-11/h4-7H,1-3H3

InChIKey

WGUSIUPNBKYKKP-UHFFFAOYSA-N

Smiles

Cc1cccc(c1OC(=O)c2cc(on2)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 500mg/kg (500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 27, Pg. 581, 1992.