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Substance Name: 1H-1,2,4-Triazole, 1-((2-(2-benzofuranyl)-4-methyl-1,3-dioxolan-2-yl)methyl)-, trans-
RN: 98519-24-5
InChIKey: PIIXAPHXKDVYRY-XHDPSFHLSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H15-N3-O3

Molecular Weight

  • 285.3015
 
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Names and Synonyms

Synonym

  • trans-1-((2-(2-Benzofuranyl)-4-methyl-1,3-dioxolan-2-yl)methyl)-1H-1,2,4-triazole

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 98519-24-5

System Generated Number

  • 0098519245

Structure Descriptors

InChI

1S/C15H15N3O3/c1-11-7-19-15(21-11,8-18-10-16-9-17-18)14-6-12-4-2-3-5-13(12)20-14/h2-6,9-11H,7-8H2,1H3/t11-,15+/m0/s1

InChIKey

PIIXAPHXKDVYRY-XHDPSFHLSA-N

Smiles

C[C@H]1CO[C@@](O1)(Cn2cncn2)c3cc4ccccc4o3

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,