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Substance Name: 2,2',3,3',4,5,5',6'-Octachlorobiphenyl
RN: 52663-75-9
UNII: 95B469I42W
InChIKey: HJBYDWKNARZTMJ-UHFFFAOYSA-N

Molecular Formula

  • C12-H2-Cl8

Molecular Weight

  • 429.772
 
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Names and Synonyms

Name of Substance

  • 2,2',3,3',4,5,5',6'-Octachlorobiphenyl

Synonyms

  • 2,2',3,3',4,5,5',6'-Octachloro-1,1'-biphenyl
  • 2,2',3,3',4,5,5',6'-Octachlorobiphenyl
  • UNII-95B469I42W

Systematic Names

  • 1,1'-Biphenyl, 2,2',3,3',4,5,5',6'-octachloro-
  • 1,1'-Biphenyl, 2,2',3,3',4,5,5'6'-octachloro-

Registry Numbers

CAS Registry Number

  • 52663-75-9

FDA UNII

  • 95B469I42W

System Generated Number

  • 0052663759

Structure Descriptors

InChI

1S/C12H2Cl8/c13-4-1-3(8(16)12(20)11(4)19)7-9(17)5(14)2-6(15)10(7)18/h1-2H

InChIKey

HJBYDWKNARZTMJ-UHFFFAOYSA-N

Smiles

c1(c2c(c(c(Cl)c(c2)Cl)Cl)Cl)c(c(cc(c1Cl)Cl)Cl)Cl

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 8.910 (none)   EST
Water Solubility 2.20E-04 mg/L 25 EXP
Vapor Pressure 2.87E-08 mm Hg 25 EST
Henry's Law Constant 1.00E-05 atm-m3/mole 25 EXP
Atmospheric OH Rate Constant 5.59E-14 cm3/molecule-sec 25 EST

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