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Substance Name: 1H-1,2,4-Triazole, 1-((2-(2-benzofuranyl)-4,5-dimethyl-1,3-dioxolan-2-yl)methyl)-
RN: 98532-74-2
InChIKey: SZOGXYNIMJKAKT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-N3-O3

Molecular Weight

  • 299.3283
 
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Names and Synonyms

Synonyms

  • 1-((2-(2-Benzofuranyl)-4,5-dimethyl-1,3-dioxolan-2-yl)methyl)-1H-1,2,4-triazole
  • 2-(Benzofuran-2-yl)-2-(1-(1H-1,2,4-triazolyl)-methyl)-4,5-dimethyl-1,3-dioxolan
  • 2-(Benzofuran-2-yl)-2-(1-(1H-1,2,4-triazolyl)-methyl)-4,5-dimethyl-1,3-dioxolan [German]

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 98532-74-2

System Generated Number

  • 0098532742

Structure Descriptors

InChI

1S/C16H17N3O3/c1-11-12(2)22-16(21-11,8-19-10-17-9-18-19)15-7-13-5-3-4-6-14(13)20-15/h3-7,9-12H,8H2,1-2H3

InChIKey

SZOGXYNIMJKAKT-UHFFFAOYSA-N

Smiles

CC1C(OC(O1)(Cn2cncn2)c3cc4ccccc4o3)C

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,