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3-Bromo-2-fluorophenol
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Name

3-Bromo-2-fluorophenol

 EINECS N/A
CAS No. 156682-53-0 Density 1.764 g/cm3
PSA 20.23000 LogP 2.29380
Solubility N/A Melting Point N/A
Formula C6H4BrFO Boiling Point 207.4 °C at 760 mmHg
Molecular Weight 191 Flash Point 79.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes  T,Xi:;
Molecular Structure Molecular Structure of 156682-53-0 (3-Bromo-2-fluoro-phenol) Hazard Symbols ToxicT, IrritantXi
Synonyms

3-Bromo-2-fluorophenol;

Article Data 2

3-Bromo-2-fluorophenol Synthetic route

38573-88-5

1-bromo-2,3-difluorobenzene

A

156682-53-0

3-bromo-2-fluoro-phenol

B

2040-89-3

2-bromo-6-fluorophenol

Conditions
ConditionsYield
Stage #1: 1-bromo-2,3-difluorobenzene With potassium trimethylsilonate In diethylene glycol dimethyl ether at 120℃; for 5h; Inert atmosphere;
Stage #2: With hydrogenchloride In diethylene glycol dimethyl ether; water at 20℃; Inert atmosphere;
156682-53-0

3-bromo-2-fluoro-phenol

100-39-0

benzyl bromide

295376-29-3

1-(benzyloxy)-3-bromo-2-fluorobenzene

Conditions
ConditionsYield
With potassium carbonate In acetone for 4h; Reflux;97%
156682-53-0

3-bromo-2-fluoro-phenol

286371-65-1

6-(benzyloxy)-4-chloro-7-methoxyquinazoline

6-benzyloxy-4-(3-bromo-2-fluorophenoxy)-7-methoxyquinazoline

Conditions
ConditionsYield
With potassium carbonate In N,N-dimethyl-formamide at 90℃; for 1h;96%
156682-53-0

3-bromo-2-fluoro-phenol

75-26-3

isopropyl bromide

1160293-59-3

1-bromo-2-fluoro-3-isopropoxybenzene

Conditions
ConditionsYield
With potassium carbonate In acetone at 60℃; for 14h; Inert atmosphere;92%
156682-53-0

3-bromo-2-fluoro-phenol

100-49-2

cyclohexylmethyl alcohol

1-bromo-3-(cyclohexylmethoxy)-2-fluorobenzene

Conditions
ConditionsYield
With di-isopropyl azodicarboxylate; triphenylphosphine In tetrahydrofuran at 20℃; for 16h;83%
156682-53-0

3-bromo-2-fluoro-phenol

6,7-dibenzyloxy-4-chloroquinazoline

6,7-dibenzyloxy-4-(3-bromo-2-fluorophenoxy)quinazoline

Conditions
ConditionsYield
With potassium carbonate In N,N-dimethyl-formamide at 100℃; for 1h;82%
156682-53-0

3-bromo-2-fluoro-phenol

benzyl (3S)-3-((4-(2-fluoro-3-pyridyl)pyrimidin-2-yl)amino)piperidine-1-carboxylate

benzyl (3S)-3-((4-(2-(3-bromo-2-fluoro-phenoxy)-3-pyridyl)pyrimidin-2-yl)amino)piperidine-1-carboxylate

Conditions
ConditionsYield
With caesium carbonate In dimethyl sulfoxide at 110℃; for 1h;76.8%
156682-53-0

3-bromo-2-fluoro-phenol

diphenyliodonium tetrafluoroborate

1-bromo-2-fluoro-3-phenoxybenzene

Conditions
ConditionsYield
Stage #1: 3-bromo-2-fluoro-phenol With potassium tert-butylate In tetrahydrofuran at 0℃; for 0.25h;
Stage #2: diphenyliodonium tetrafluoroborate In tetrahydrofuran at 40℃; for 1h;		76%
Stage #1: 3-bromo-2-fluoro-phenol With potassium tert-butylate In tetrahydrofuran at 0℃; for 0.25h;
Stage #2: diphenyliodonium tetrafluoroborate In tetrahydrofuran at 40℃; for 1h;		76%
156682-53-0

3-bromo-2-fluoro-phenol

1426251-76-4

bis(3-fluorophenyl)iodonium tetrafluoroborate

1-bromo-2-fluoro-3-(3-fluorophenoxy)benzene

Conditions
ConditionsYield
Stage #1: 3-bromo-2-fluoro-phenol With potassium tert-butylate In tetrahydrofuran at 0℃; for 0.25h;
Stage #2: bis(3-fluorophenyl)iodonium tetrafluoroborate In tetrahydrofuran at 40℃; for 1h;		71%
Stage #1: 3-bromo-2-fluoro-phenol With potassium tert-butylate In tetrahydrofuran at 0℃; for 0.25h;
Stage #2: bis(3-fluorophenyl)iodonium tetrafluoroborate In tetrahydrofuran at 40℃; for 1h;		71%
156682-53-0

3-bromo-2-fluoro-phenol

1458-98-6

2-methyl-3-bromo-1-propene

C10H10BrFO

Conditions
ConditionsYield
With potassium carbonate In acetonitrile for 18h; Inert atmosphere; Reflux;70%

3-Bromo-2-fluorophenol Specification

The Phenol,3-bromo-2-fluoro- is an organic compound with the formula C6H4BrFO. The systematic name of this chemical is 3-Bromo-2-fluorophenol. With the CAS registry number 156682-53-0, it is also named as 3-Bromo-2-fluoro-phenol. Besides, its molecular weight is 190.998.

Physical properties about Phenol,3-bromo-2-fluoro- are: (1)ACD/LogP: 2.77; (2)ACD/LogD (pH 5.5): 2.77; (3)ACD/LogD (pH 7.4): 2.61; (4)ACD/BCF (pH 5.5): 74.74; (5)ACD/BCF (pH 7.4): 51.76; (6)ACD/KOC (pH 5.5): 762.04; (7)ACD/KOC (pH 7.4): 527.73; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 20.23 Å2; (12)Index of Refraction: 1.575; (13)Molar Refractivity: 35.81 cm3; (14)Molar Volume: 108.2 cm3; (15)Polarizability: 14.19 10-24 cm3; (16)Surface Tension: 44.6 dyne/cm; (17)Density: 1.764 g/cm3; (18)Flash Point: 79.2 °C; (19)Enthalpy of Vaporization: 46.17 kJ/mol; (20)Boiling Point: 207.4 °C at 760 mmHg; (21)Vapour Pressure: 0.157 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C6H4BrFO/c7-4-2-1-3-5(9)6(4)8/h1-3,9H
(2)InChIKey: MEZFCUMYQXLFOV-UHFFFAOYAF
(3)Std. InChI: InChI=1S/C6H4BrFO/c7-4-2-1-3-5(9)6(4)8/h1-3,9H
(4)Std. InChIKey: MEZFCUMYQXLFOV-UHFFFAOYSA-N

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