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Substance Name: 3H-1,2,4-Triazol-3-one, 1,2-dihydro-5-(1,3-benzodioxol-5-yl)-
RN: 108132-85-0
InChIKey: ORGPIEWLKKJENX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H7-N3-O3

Molecular Weight

  • 205.1723
 
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Names and Synonyms

Synonyms

  • 1,2-Dihydro-5-(1,3-benzodioxol-5-yl)-3H-1,2,4-triazol-3-one
  • BRN 5956268

Systematic Name

  • 3H-1,2,4-Triazol-3-one, 1,2-dihydro-5-(1,3-benzodioxol-5-yl)-

Registry Numbers

CAS Registry Number

  • 108132-85-0

System Generated Number

  • 0108132850

Structure Descriptors

InChI

1S/C9H7N3O3/c13-9-10-8(11-12-9)5-1-2-6-7(3-5)15-4-14-6/h1-3H,4H2,(H2,10,11,12,13)

InChIKey

ORGPIEWLKKJENX-UHFFFAOYSA-N

Smiles

c1cc2c(cc1c3[nH][nH]c(=O)n3)OCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 100mg/kg (100mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 21, Pg. 277, 1986.
mammal (species unspecified) LD50 oral 500mg/kg (500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 21, Pg. 277, 1986.