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Substance Name: 2,2',4,5,5'-Pentabromobiphenyl
RN: 67888-96-4
UNII: 03SL1NG15Q
InChIKey: OELBLPCWLAWABI-UHFFFAOYSA-N

Molecular Formula

  • C12-H5-Br5

Molecular Weight

  • 548.692
 
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Names and Synonyms

Name of Substance

  • 2,2',4,5,5'-Pentabromobiphenyl

Synonyms

  • 2,4,5,2',5'-Pentabromo-1,1'-biphenyl
  • UNII-03SL1NG15Q

Systematic Name

  • 1,1'-Biphenyl, 2,2',4,5,5'-pentabromo-

Registry Numbers

CAS Registry Number

  • 67888-96-4

FDA UNII

  • 03SL1NG15Q

System Generated Number

  • 0067888964

Structure Descriptors

InChI

1S/C12H5Br5/c13-6-1-2-9(14)7(3-6)8-4-11(16)12(17)5-10(8)15/h1-5H

InChIKey

OELBLPCWLAWABI-UHFFFAOYSA-N

Smiles

c1(c2c(ccc(c2)Br)Br)c(cc(Br)c(c1)Br)Br

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 7.1 (none)   EXP
Water Solubility 1.03E-04 mg/L 25 EXP
Vapor Pressure 2.12E-08 mm Hg 25 EST
Henry's Law Constant 4.15E-06 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.83E-13 cm3/molecule-sec 25 EST

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