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Substance Name: Isophthalanilide, 4-hydroxy-2',2'',5',5''-tetrabromo-
RN: 29114-55-4
InChIKey: KTGJMRGKXXGEPI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H12-Br4-N2-O3

Molecular Weight

  • 647.942
 
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Names and Synonyms

Synonym

  • 4-Hydroxy-2',2'',5',5''-tetrabromoisophthalanilide

Systematic Name

  • Isophthalanilide, 4-hydroxy-2',2'',5',5''-tetrabromo-

Registry Numbers

CAS Registry Number

  • 29114-55-4

System Generated Number

  • 0029114554

Structure Descriptors

InChI

1S/C20H12Br4N2O3/c21-11-2-4-14(23)16(8-11)25-19(28)10-1-6-18(27)13(7-10)20(29)26-17-9-12(22)3-5-15(17)24/h1-9,27H,(H,25,28)(H,26,29)

InChIKey

KTGJMRGKXXGEPI-UHFFFAOYSA-N

Smiles

C(c1cc(C(=O)Nc2c(ccc(c2)Br)Br)c(cc1)O)(=O)Nc1c(ccc(c1)Br)Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 550mg/kg (550mg/kg)   Bollettino Chimico Farmaceutico. Vol. 108, Pg. 483, 1969.
mouse LD oral > 550mg/kg (550mg/kg)   Bollettino Chimico Farmaceutico. Vol. 108, Pg. 483, 1969.