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Substance Name: o-Aniso-m-toluidide, 5-bromo-alpha',alpha',alpha'-trifluoro-alpha-1H-tetrazol-5-yl-
RN: 35421-59-1
InChIKey: MJBUCQXIYJYLCP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H11-Br-F3-N5-O2

Molecular Weight

  • 442.194
 
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Names and Synonyms

Synonyms

  • 5-Bromo-2-(1H-tetrazol-5-ylmethoxy)-alpha,alpha,alpha-trifluoro-m-benzotoluidide
  • BRN 1186705

Systematic Name

  • o-Aniso-m-toluidide, 5-bromo-alpha',alpha',alpha'-trifluoro-alpha-1H-tetrazol-5-yl-

Registry Numbers

CAS Registry Number

  • 35421-59-1

System Generated Number

  • 0035421591

Structure Descriptors

InChI

1S/C16H11BrF3N5O2/c17-10-4-5-13(27-8-14-22-24-25-23-14)12(7-10)15(26)21-11-3-1-2-9(6-11)16(18,19)20/h1-7H,8H2,(H,21,26)(H,22,23,24,25)

InChIKey

MJBUCQXIYJYLCP-UHFFFAOYSA-N

Smiles

C(c1c(ccc(c1)Br)OCc1nnn[nH]1)(=O)Nc1cc(ccc1)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 375mg/kg (375mg/kg)   Journal of Pharmacy and Pharmacology. Vol. 23, Pg. 857, 1971.