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Substance Name: 2,3-Dichloronitrobenzene
RN: 3209-22-1
UNII: 985EWS35KG
InChIKey: CMVQZRLQEOAYSW-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C6-H3-Cl2-N-O2

Molecular Weight

  • 192.001
 
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Names and Synonyms

Name of Substance

  • 2,3-Dichloronitrobenzene

Synonyms

  • 1,2-Dichloro-3-nitrobenzene
  • 2,3-Dichloro-1-nitrobenzene
  • 2,3-Dichloronitrobenzene
  • 4-05-00-00725 (Beilstein Handbook Reference)
  • Benzene, 1,2-dichloro-3-nitro-
  • BRN 2048029
  • CCRIS 5901
  • EC 221-717-7
  • EINECS 221-717-7
  • HSDB 4279
  • NSC 60641
  • UNII-985EWS35KG

Systematic Names

  • 1,2-Dichloro-3-nitrobenzene
  • 2,3-Dichloronitrobenzene
  • Benzene, 1,2-dichloro-3-nitro-

Superlist Name

  • Benzene, 1,2-dichloro-3-nitro-

Registry Numbers

CAS Registry Number

  • 3209-22-1

FDA UNII

  • 985EWS35KG

System Generated Number

  • 0003209221

Structure Descriptors

InChI

1S/C6H3Cl2NO2/c7-4-2-1-3-5(6(4)8)9(10)11/h1-3H

InChIKey

CMVQZRLQEOAYSW-UHFFFAOYSA-N

Smiles

c1(c(c(ccc1)Cl)Cl)[N+](=O)[O-]

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 61.5 deg C   EXP
Boiling Point 257.5 deg C   EXP
log P (octanol-water) 3.05 (none)   EXP
Water Solubility 62.4 mg/L 20 EXP
Vapor Pressure 5.05E-03 mm Hg 25 EST
Henry's Law Constant 1.17E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 5.01E-14 cm3/molecule-sec 25 EST

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