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Substance Name: 3H-1,2,4-Triazol-3-one, 2,4-dihydro-5-(1,3-benzodioxol-5-yl)-4-methyl-
RN: 108132-88-3
InChIKey: QWYJYHUAIBWZQX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H9-N3-O3

Molecular Weight

  • 219.1991
 
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Names and Synonyms

Synonyms

  • 2,4-Dihydro-5-(1,3-benzodioxol-5-yl)-4-methyl-3H-1,2,4-triazol-3-one
  • BRN 5954232

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 108132-88-3

System Generated Number

  • 0108132883

Structure Descriptors

InChI

1S/C10H9N3O3/c1-13-9(11-12-10(13)14)6-2-3-7-8(4-6)16-5-15-7/h2-4H,5H2,1H3,(H,12,14)

InChIKey

QWYJYHUAIBWZQX-UHFFFAOYSA-N

Smiles

Cn1c(n[nH]c1=O)c2ccc3c(c2)OCO3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 200mg/kg (200mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 21, Pg. 277, 1986.
mammal (species unspecified) LD50 oral 700mg/kg (700mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 21, Pg. 277, 1986.