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Substance Name: 3-Isoxazolecarboxylic acid, 5-methyl-, 2-heptylhydrazide
RN: 100454-15-7
InChIKey: VOLLVHDZKFCEQK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H21-N3-O3

Molecular Weight

  • 239.3169
 
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Names and Synonyms

Synonym

  • 5-Methyl-3-isoxazolecarboxylic acid 2-heptylhydrazide

Systematic Name

  • 3-Isoxazolecarboxylic acid, 5-methyl-, 2-heptylhydrazide

Registry Numbers

CAS Registry Number

  • 100454-15-7

System Generated Number

  • 0100454157

Structure Descriptors

InChI

1S/C12H21N3O2/c1-3-4-5-6-7-8-13-14-12(16)11-9-10(2)17-15-11/h9,13H,3-8H2,1-2H3,(H,14,16)

InChIKey

VOLLVHDZKFCEQK-UHFFFAOYSA-N

Smiles

CCCCCCCNNC(=O)c1cc(on1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 185mg/kg (185mg/kg)   Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 133, 1960.