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Substance Name: 1,2,3,6,7-Pentachlorodibenzofuran
RN: 57117-42-7
UNII: 8A204S7BGE
InChIKey: NZUPQBVDIWCPBX-UHFFFAOYSA-N

Molecular Formula

  • C12-H3-Cl5-O

Molecular Weight

  • 340.4197
 
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Names and Synonyms

Name of Substance

  • 1,2,3,6,7-Pentachlorodibenzofuran

Synonyms

  • 1,2,3,6,7-Pentachlorodibenzofuran
  • UNII-8A204S7BGE

Systematic Name

  • Dibenzofuran, 1,2,3,6,7-pentachloro-

Registry Numbers

CAS Registry Number

  • 57117-42-7

FDA UNII

  • 8A204S7BGE

System Generated Number

  • 0057117427

Structure Descriptors

InChI

1S/C12H3Cl5O/c13-5-2-1-4-8-7(18-12(4)10(5)16)3-6(14)9(15)11(8)17/h1-3H

InChIKey

NZUPQBVDIWCPBX-UHFFFAOYSA-N

Smiles

c1cc(c(c2c1c3c(o2)cc(c(c3Cl)Cl)Cl)Cl)Cl

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 6.26 (none)   EXP
Water Solubility 2.48E-03 mg/L 25 EST
Vapor Pressure 3.46E-07 mm Hg 25 EST
Henry's Law Constant 1.14E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.15E-13 cm3/molecule-sec 25 EST

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