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4-BROMO-3-CHLOROPHENOL

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4-BROMO-3-CHLOROPHENOL Basic information

Product Name:
4-BROMO-3-CHLOROPHENOL
Synonyms:
  • 2-Chloro-4-hydroxybromobenzene
  • Phenol,4-bromo-3-chloro-
  • 4-BROMO-3-CHLOROPHENOL
CAS:
13631-21-5
MF:
C6H4BrClO
MW:
207.45
Product Categories:
  • Chlorine Compounds
  • Phenols
  • Bromine Compounds
Mol File:
13631-21-5.mol
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4-BROMO-3-CHLOROPHENOL Chemical Properties

Melting point:
64-66°C
Boiling point:
267.5±20.0 °C(Predicted)
Density 
1.788±0.06 g/cm3(Predicted)
storage temp. 
Inert atmosphere,Room Temperature
form 
powder to crystal
pka
8.43±0.18(Predicted)
color 
White to Almost white
Water Solubility 
Slightly soluble in water.
BRN 
3236445
InChI
InChI=1S/C6H4BrClO/c7-5-2-1-4(9)3-6(5)8/h1-3,9H
InChIKey
FQEYHIPPYOSPLF-UHFFFAOYSA-N
SMILES
C1(O)=CC=C(Br)C(Cl)=C1
CAS DataBase Reference
13631-21-5(CAS DataBase Reference)
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Safety Information

Hazard Codes 
Xn
Risk Statements 
36/37/38-22
Safety Statements 
26-36/37/39
WGK Germany 
WGK 3
HS Code 
2908.19.6000
Storage Class
11 - Combustible Solids
Hazard Classifications
Acute Tox. 4 Oral

MSDS

  • Language:English Provider:ALFA
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4-BROMO-3-CHLOROPHENOL Usage And Synthesis

Uses

4-Bromo-3-chlorophenol is used as a precursor in organic synthesis to prepare 4-(benzyloxy)-l-bromo-2-chlorobenzene by reaction with benzyl bromide.

Synthesis

45.7 g (0.466 mol) of 3-chlorophenol and 80 mL of carbon tetrachloride were added into a four-necked flask, and 82.74 g (0.465 mol) of NBS was added in batches under stirring, and the reaction was carried out at a certain temperature temperature, and the samples were taken every 2 h, and analyzed by gas chromatography, and the reaction was stopped when the mass fraction of 3-chlorophenol was less than 1 %. Filtering, the filtrate was washed with water, the oil layer was taken for distillation, and the 37-38 ?? / 0.000 4 MPa fraction was collected as the 4-bromo-3-chlorophenol product, the purity of which was greater than 98% (GC), with a yield of 87%.

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