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Substance Name: p-Bromochlorobenzene
RN: 106-39-8
UNII: LXY3B1SO4F
InChIKey: NHDODQWIKUYWMW-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C6-H4-Br-Cl

Molecular Weight

  • 191.455
 
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Names and Synonyms

Name of Substance

  • p-Bromochlorobenzene

Synonyms

  • 1-Bromo-4-chlorobenzene
  • 1-Chloro-4-bromobenzene
  • 4-Bromochlorobenzene
  • 4-Chloro-1-bromobenzene
  • 4-Chlorobromobenzene
  • 4-Chlorophenyl bromide
  • AI3-15313
  • EINECS 203-392-3
  • NSC 17587
  • p-Bromochlorobenzene
  • p-Bromoclorobenzene
  • p-Bromophenyl chloride
  • p-Chlorobromobenzene
  • p-Chlorophenyl bromide
  • UNII-LXY3B1SO4F

Systematic Names

  • 1-Bromo-4-chlorobenzene
  • Benzene, 1-bromo-4-chloro-

Registry Numbers

CAS Registry Number

  • 106-39-8

FDA UNII

  • LXY3B1SO4F

System Generated Number

  • 0000106398

Structure Descriptors

InChI

1S/C6H4BrCl/c7-5-1-3-6(8)4-2-5/h1-4H

InChIKey

NHDODQWIKUYWMW-UHFFFAOYSA-N

Smiles

c1(ccc(Br)cc1)Cl

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 68 deg C   EXP
Boiling Point 196 deg C   EXP
log P (octanol-water) 3.54 (none)   EXP
Water Solubility 44.9 mg/L 25 EXP
Vapor Pressure 0.258 mm Hg 25 EXP
Henry's Law Constant 1.45E-03 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.93E-13 cm3/molecule-sec 25 EST

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