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Substance Name: 3,4,5,3',4',5'-Hexachlorobiphenyl
RN: 32774-16-6
UNII: T2P1WH546D
InChIKey: ZHLICBPIXDOFFG-UHFFFAOYSA-N

Classification Code

  • Reproductive Effect

Molecular Formula

  • C12-H4-Cl6

Molecular Weight

  • 360.882
 
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Names and Synonyms

Name of Substance

  • 3,4,5,3',4',5'-Hexachlorobiphenyl

Synonyms

  • 1,1'-Biphenyl, 3,3',4,4',5,5'-hexachloro-
  • 3,3',4,4',5,5'-Hexachloro-1,1'-biphenyl
  • 3,3',4,4',5,5'-Hexachlorobiphenyl
  • 3,4,5,3',4',5'-Hexa coplanar polychlorinated biphenyl
  • 3,4,5,3',4',5'-Hexachlorobiphenyl
  • 3-05-00-01742 (Beilstein Handbook Reference)
  • Biphenyl, 3,3',4,4',5,5'-hexachloro-
  • BRN 1990183
  • HSDB 3948
  • PCB 169
  • UNII-T2P1WH546D

Systematic Names

  • 1,1'-Biphenyl, 3,3',4,4',5,5'-hexachloro-
  • 1,1'-Biphenyl, 3,3',4,4',5,5'-hexachloro- (9CI)
  • Biphenyl, 3,3',4,4',5,5'-hexachloro-

Registry Numbers

CAS Registry Number

  • 32774-16-6

FDA UNII

  • T2P1WH546D

System Generated Number

  • 0032774166

Structure Descriptors

InChI

InChI=1S/C12H4Cl6/c13-7-1-5(2-8(14)11(7)17)6-3-9(15)12(18)10(16)4-6/h1-4H

InChIKey

ZHLICBPIXDOFFG-UHFFFAOYSA-N

Smiles

Clc1cc(cc(Cl)c1Cl)c2cc(Cl)c(Cl)c(Cl)c2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 oral 223ug/kg (0.223mg/kg)   Pergamon Series on Environmental Science. Vol. 5, Pg. 367, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 7.41 (none)   EXP
Water Solubility 5.10E-04 mg/L 25 EXP
Vapor Pressure 5.81E-07 mm Hg 25 EST
Henry's Law Constant 6.85E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.04E-13 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.