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Substance Name: 1H-Pyrazole, 1-(1,3-benzodioxol-5-ylcarbonyl)-3,5-dimethyl-
RN: 108132-58-7
InChIKey: IXCICYVXWKMZOL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H12-N2-O3

Molecular Weight

  • 244.2488
 
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Names and Synonyms

Synonyms

  • 1-(1,3-Benzodioxol-5-ylcarbonyl)-3,5-dimethyl-1H-pyrazole
  • BRN 5958195

Systematic Name

  • 1H-Pyrazole, 1-(1,3-benzodioxol-5-ylcarbonyl)-3,5-dimethyl-

Registry Numbers

CAS Registry Number

  • 108132-58-7

System Generated Number

  • 0108132587

Structure Descriptors

InChI

1S/C13H12N2O3/c1-8-5-9(2)15(14-8)13(16)10-3-4-11-12(6-10)18-7-17-11/h3-6H,7H2,1-2H3

InChIKey

IXCICYVXWKMZOL-UHFFFAOYSA-N

Smiles

Cc1cc(n(n1)C(=O)c2ccc3c(c2)OCO3)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal > 400mg/kg (400mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 21, Pg. 277, 1986.
mammal (species unspecified) LD50 oral > 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 21, Pg. 277, 1986.