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Substance Name: 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-(hydroxymethyl)-
RN: 145441-10-7
InChIKey: NVAIIBMMCLUVTC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H14-N2-O3

Molecular Weight

  • 246.2646
 
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Names and Synonyms

Synonyms

  • BRN 5819073
  • N-(2,6-Dimethylphenyl)-3-(hydroxymethyl)-5-isoxazolecarboxamide

Systematic Name

  • 5-Isoxazolecarboxamide, N-(2,6-dimethylphenyl)-3-(hydroxymethyl)-

Registry Numbers

CAS Registry Number

  • 145441-10-7

System Generated Number

  • 0145441107

Structure Descriptors

InChI

1S/C13H14N2O3/c1-8-4-3-5-9(2)12(8)14-13(17)11-6-10(7-16)15-18-11/h3-6,16H,7H2,1-2H3,(H,14,17)

InChIKey

NVAIIBMMCLUVTC-UHFFFAOYSA-N

Smiles

Cc1cccc(c1NC(=O)c2cc(no2)CO)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 300mg/kg (300mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 27, Pg. 581, 1992.