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Substance Name: 1H-1,2,4-Triazole, 1-((2-(5-chloro-2-benzofuranyl)-1,3-dioxolan-2-yl)methyl)-
RN: 98519-05-2
InChIKey: HFBXMVJNVNWQML-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H12-Cl-N3-O3

Molecular Weight

  • 305.7198
 
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Names and Synonyms

Synonyms

  • 1-((2-(5-Chloro-2-benzofuranyl)-1,3-dioxolan-2-yl)methyl)-1H-1,2,4-triazole
  • 2-(5-Chloro-benzofuran-2-yl)-2-(1-(1H-1,2,4-triazolyl)-methyl)-1,3-dioxolan
  • 2-(5-Chloro-benzofuran-2-yl)-2-(1-(1H-1,2,4-triazolyl)-methyl)-1,3-dioxolan [German]

Systematic Name

  • 1H-1,2,4-Triazole, 1-((2-(5-chloro-2-benzofuranyl)-1,3-dioxolan-2-yl)methyl)-

Registry Numbers

CAS Registry Number

  • 98519-05-2

System Generated Number

  • 0098519052

Structure Descriptors

InChI

1S/C14H12ClN3O3/c15-11-1-2-12-10(5-11)6-13(21-12)14(19-3-4-20-14)7-18-9-16-8-17-18/h1-2,5-6,8-9H,3-4,7H2

InChIKey

HFBXMVJNVNWQML-UHFFFAOYSA-N

Smiles

c1cc2c(cc1Cl)cc(o2)C3(OCCO3)Cn4cncn4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   European Patent Application. Vol. #0130151,
rat LD50 oral > 1gm/kg (1000mg/kg)   European Patent Application. Vol. #0130151,