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Substance Name: Predioxin
RN: 53555-01-4
InChIKey: PVLWIBDPWVHDIN-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C12-H5-Cl5-O2

Molecular Weight

  • 358.435
 
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Names and Synonyms

Name of Substance

  • Predioxin

Synonyms

  • 2',3,4,4',5-Pentachloro-2-hydroxydiphenyl ether
  • 2,3,4-Trichloro-6-(2,4-dichlorophenoxy)phenol
  • 2-(2,4-Dichlorophenoxy)-4,5,6-trichlorophenol
  • 4,5,6-Trichloro-2-(2,4-dichlorophenoxy)phenol
  • 6-(2,4-Dichlorophenoxy)-2,3,4-trichlorophenol
  • BRN 4522298
  • Cl5-Predioxin

Systematic Names

  • Phenol, 2,3,4-trichloro-6-(2,4-dichlorophenoxy)-
  • Phenol, 2-(2,4-dichlorophenoxy)-4,5,6-trichloro-
  • Phenol, 6-(2,4-dichlorophenoxy)-2,3,4-trichloro- (9CI)

Registry Numbers

CAS Registry Number

  • 53555-01-4

System Generated Number

  • 0053555014

Structure Descriptors

InChI

1S/C12H5Cl5O2/c13-5-1-2-8(6(14)3-5)19-9-4-7(15)10(16)11(17)12(9)18/h1-4,18H

InChIKey

PVLWIBDPWVHDIN-UHFFFAOYSA-N

Smiles

c1(cc(ccc1Oc1c(c(Cl)c(c(c1)Cl)Cl)O)Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 170mg/kg (170mg/kg) BEHAVIORAL: IRRITABILITY

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Journal of Toxicology and Environmental Health. Vol. 12, Pg. 245, 1983.