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Substance Name: 1H-1,2,4-Triazole, 1-((2-(5,7-dichloro-2-benzofuranyl)-4,5-dimethyl-1,3-dioxolan-2-yl)methyl)-
RN: 98519-01-8
InChIKey: MOWWJUKSUIQMGV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H15-Cl2-N3-O3

Molecular Weight

  • 368.2185
 
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Names and Synonyms

Synonym

  • 2-(5,7-Dichlor-benzofuran-2-yl)-2-(1-(1H-1,2,4-triazolyl)-methyl)-4,5-dimethyl-1,3-dioxolan

Systematic Name

  • 1H-1,2,4-Triazole, 1-((2-(5,7-dichloro-2-benzofuranyl)-4,5-dimethyl-1,3-dioxolan-2-yl)methyl)-

Registry Numbers

CAS Registry Number

  • 98519-01-8

System Generated Number

  • 0098519018

Structure Descriptors

InChI

1S/C16H15Cl2N3O3/c1-9-10(2)24-16(23-9,6-21-8-19-7-20-21)14-4-11-3-12(17)5-13(18)15(11)22-14/h3-5,7-10H,6H2,1-2H3

InChIKey

MOWWJUKSUIQMGV-UHFFFAOYSA-N

Smiles

CC1C(OC(O1)(Cn2cncn2)c3cc4cc(cc(c4o3)Cl)Cl)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,