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Substance Name: 2,3,4,5-Tetrachloronitrobenzene
RN: 879-39-0
UNII: N2WU0K04EH
InChIKey: MTBYTWZDRVOMBR-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Fungicide, Bactericide, Wood Preservative
  • Growth Regulator / Fertilizer
  • Tumor Data

Molecular Formula

  • C6-H-Cl4-N-O2

Molecular Weight

  • 260.891
 
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Names and Synonyms

Name of Substance

  • 2,3,4,5-Tetrachloronitrobenzene

Synonyms

  • 1,2,3,4-Tetrachloro-5-nitrobenzene
  • 1-Nitro-2,3,4,5-tetrachlorobenzene
  • 2,3,4,5-Tetrachloro-1-nitrobenzene
  • 2,3,4,5-Tetrachloronitrobenzene
  • 4-05-00-00728 (Beilstein Handbook Reference)
  • AI3-23025
  • Benzene, 1,2,3,4-tetrachloro-5-nitro-
  • Benzene, 5-nitro-1,2,3,4-tetrachloro-
  • BRN 2273256
  • CCRIS 5938
  • DB-905
  • EINECS 212-906-5
  • Folosan DB-905 fumite
  • HSDB 4286
  • NSC 5577
  • NSC 57752
  • TCBN
  • UNII-N2WU0K04EH

Systematic Names

  • 2,3,4,5-Tetrachloronitrobenzene
  • Benzene, 1,2,3,4-tetrachloro-5-nitro-

Registry Numbers

CAS Registry Number

  • 879-39-0

FDA UNII

  • N2WU0K04EH

System Generated Number

  • 0000879390

Structure Descriptors

InChI

1S/C6HCl4NO2/c7-2-1-3(11(12)13)5(9)6(10)4(2)8/h1H

InChIKey

MTBYTWZDRVOMBR-UHFFFAOYSA-N

Smiles

c1(c(c(c(Cl)c(c1)Cl)Cl)Cl)[N+](=O)[O-]

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.93 (none)   EXP
Water Solubility 7.3 mg/L 20 EXP
Vapor Pressure 1.38E-04 mm Hg 25 EST
Henry's Law Constant 2.34E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.19E-15 cm3/molecule-sec 25 EST

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