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Substance Name: 4H-1-Benzopyran-4-one, 6-bromo-2-(1-methyl-1H-1,2,3-triazol-4-yl)-
RN: 131924-45-3
InChIKey: JJTLPCXFOKCMJK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H8-Br-N3-O2

Molecular Weight

  • 306.1182
 
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Names and Synonyms

Synonyms

  • 6-Bromo-2-(1-methyl-1H-1,2,3-triazol-4-yl)-4H-1-benzopyran-4-one
  • BRN 4195014

Systematic Name

  • 4H-1-Benzopyran-4-one, 6-bromo-2-(1-methyl-1H-1,2,3-triazol-4-yl)-

Registry Numbers

CAS Registry Number

  • 131924-45-3

System Generated Number

  • 0131924453

Structure Descriptors

InChI

1S/C12H8BrN3O2/c1-16-6-9(14-15-16)12-5-10(17)8-4-7(13)2-3-11(8)18-12/h2-6H,1H3

InChIKey

JJTLPCXFOKCMJK-UHFFFAOYSA-N

Smiles

Cn1cc(nn1)c2cc(=O)c3cc(ccc3o2)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 100mg/kg (100mg/kg)   Farmaco. Vol. 45, Pg. 847, 1990.