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3-Bromo-5-chlorophenol
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Name

3-Bromo-5-chlorophenol

 EINECS N/A
CAS No. 56962-04-0 Density 1.788g/cm3
PSA 20.23000 LogP 2.80810
Solubility N/A Melting Point 66-70℃
Formula C6H4BrClO Boiling Point 258.397oC at 760 mmHg
Molecular Weight 207.454 Flash Point 110.075oC
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 56962-04-0 (3-Bromo-5-chlorophenol) Hazard Symbols N/A
Synonyms

Phenol, 3-bromo-5-chloro-;3-bromo-5-chloro-phenol;3-Brom-5-chlor-phenol;2-AMINO-5-(2-PYRIDYL)-1,3,4-OXADIAZOLE;

Article Data 13

3-Bromo-5-chlorophenol Synthetic route

174913-12-3

1-bromo-3-chloro-5-methoxybenzene

56962-04-0

3-bromo-5-chlorophenol

Conditions
ConditionsYield
Stage #1: 1-bromo-3-chloro-5-methoxybenzene With lithium iodide In 2,4,6-trimethyl-pyridine at 170℃; for 4h;
Stage #2: With hydrogenchloride In 2,4,6-trimethyl-pyridine; water at 20℃;		94%
With hydrogen bromide; acetic acid In water at 120℃; for 40h;
Stage #1: 1-bromo-3-chloro-5-methoxybenzene With boron tribromide In dichloromethane at 20℃;
Stage #2: With water In dichloromethane at 20℃;
Stage #1: 1-bromo-3-chloro-5-methoxybenzene With boron tribromide In dichloromethane at 20℃;
Stage #2: With water In dichloromethane at 20℃;
108-37-2

1-bromo-3-chlorobenzene

56962-04-0

3-bromo-5-chlorophenol

Conditions
ConditionsYield
Stage #1: 1-bromo-3-chlorobenzene With (1,5-cyclooctadiene)(methoxy)iridium(I) dimer; bis(pinacol)diborane; 4,4'-di-tert-butyl-2,2'-bipyridine In hexane at 20℃; for 18h; Inert atmosphere;
Stage #2: With Oxone In water; acetone for 0.166667h;		81%
Stage #1: 1-bromo-3-chlorobenzene With (1,5-cyclooctadiene)(methoxy)iridium(I) dimer; bis(pinacol)diborane; 4,4'-di-tert-butyl-2,2'-bipyridine In hexane at 20℃; for 18h; Inert atmosphere;
Stage #2: With Oxone In water; acetone for 0.166667h;		81%
Stage #1: 1-bromo-3-chlorobenzene With 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; (η5-indenyl)(η4-1,5-cyclooctadiene)iridium(I); 1,2-bis(dimethylphosphanyl)ethane at 150℃; for 3.5h; Inert atmosphere;
Stage #2: With Oxone; water In acetone Cooling with ice;		62%
Multi-step reaction with 2 steps
1: 1,2-bis(dimethylphosphino)ethane; (indenyl)Ir(1,5-cyclooctadiene) / 3.5 h / 150 °C
2: aq. oxone / acetone / 0.12 h / 25 °C
View Scheme
Multi-step reaction with 2 steps
1: 1,2-bis(dimethylphosphanyl)ethane / 150 °C
2: oxone; water / acetone / 0.12 h / 25 °C
View Scheme
210992-77-1

3-chloro-5-(4-methoxybenzyloxy)bromobenzene

56962-04-0

3-bromo-5-chlorophenol

Conditions
ConditionsYield
With methanesulfonic acid; 1,3-Dimethoxybenzene In toluene at 10℃;81%
87504-69-6

3-chloro-2,4,5,6-tetrabromophenol

A

108-86-1

bromobenzene

B

56962-04-0

3-bromo-5-chlorophenol

Conditions
ConditionsYield
With aluminium trichloride; benzene
883195-40-2

3-amino-5-chlorophenol

56962-04-0

3-bromo-5-chlorophenol

7446-70-0

aluminium trichloride

87504-69-6

3-chloro-2,4,5,6-tetrabromophenol

71-43-2

benzene

A

108-86-1

bromobenzene

B

56962-04-0

3-bromo-5-chlorophenol

2-(3-bromo-5-chlorophenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

56962-04-0

3-bromo-5-chlorophenol

Conditions
ConditionsYield
With Oxone In acetone at 25℃; for 0.116667h;
With Oxone In water; acetone at 0 - 25℃; for 0.15 - 0.25h;
With Oxone; sodium hydroxide; sodium hydrogencarbonate In water; acetone at 0℃; for 0.25h;
With Oxone; sodium hydroxide In water; acetone at 0℃; for 0.283333 - 0.333333h;
With oxone; water In acetone at 25℃; for 0.116667h;
108-43-0

3-monochlorophenol

56962-04-0

3-bromo-5-chlorophenol

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: iron powder; bromine
2: aluminium chloride; benzene
View Scheme
33863-76-2

1-bromo-3-chloro-5-fluorobenzene

56962-04-0

3-bromo-5-chlorophenol

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1.1: potassium tert-butylate / tetrahydrofuran / 40 °C
1.2: 60 °C
2.1: methanesulfonic acid; 1,3-Dimethoxybenzene / toluene / 10 °C
View Scheme
Multi-step reaction with 2 steps
1.1: N,N-dimethyl-formamide / 20 °C
2.1: boron tribromide / dichloromethane / 20 °C
2.2: 20 °C
View Scheme
1155847-43-0

4-chloro-3-fluoropicolinonitrile

56962-04-0

3-bromo-5-chlorophenol

1155847-61-2

3-(3-bromo-5-chlorophenoxy)-4-chloropyridine-2-carbonitrile

Conditions
ConditionsYield
With potassium carbonate In N,N-dimethyl-formamide at 55℃; for 0.333333h;100%
With potassium carbonate In N,N-dimethyl-formamide at 55℃; for 0.166667h;

3-Bromo-5-chlorophenol Chemical Properties

Molecular Structure of 3-Bromo-5-chlorophenol (CAS NO.56962-04-0):

Systematic Name: 3-Bromo-5-chlorophenol 
Molecular Formula: C6H4BrClO
Molecular Weight: 207.45
CAS Registry Number: 56962-04-0 
H bond acceptors: 1
H bond donors: 1
Freely Rotating Bonds: 1
Index of Refraction: 1.619
Molar Refractivity: 40.72 cm3
Molar Volume: 115.999 cm3
Surface Tension: 50.126 dyne/cm
Density: 1.788 g/cm3
Flash Point: 110.075 °C
Enthalpy of Vaporization: 51.602 kJ/mol
Boiling Point: 258.397 °C at 760 mmHg
Vapour Pressure: 0.009 mmHg at 25 °C
SMILES: Oc1cc(Br)cc(Cl)c1
InChI: InChI=1/C6H4BrClO/c7-4-1-5(8)3-6(9)2-4/h1-3,9H
InChIKey: GMGWXLPFRHYWAS-UHFFFAOYAJ 
Product Categories: Bromine Compounds; Chlorine Compounds; Phenols

3-Bromo-5-chlorophenol Specification

 3-Bromo-5-chlorophenol (CAS NO.56962-04-0), its Synonym is Phenol, 3-bromo-5-chloro- .

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