3-Bromo-4-fluorophenol Chemical Properties

Boiling point:

78°C/0.5mmHg(lit.)

Density 

1.764±0.06 g/cm3(Predicted)

storage temp. 

Inert atmosphere,2-8°C

solubility 

soluble in Methanol

form 

Crystalline

pka

9.01±0.18(Predicted)

color 

Yellow-green

InChI

InChI=1S/C6H4BrFO/c7-5-3-4(9)1-2-6(5)8/h1-3,9H

InChIKey

QWTULQLVGNZMLF-UHFFFAOYSA-N

SMILES

C1(O)=CC=C(F)C(Br)=C1

CAS DataBase Reference

27407-11-0(CAS DataBase Reference)

Safety Information

Hazard Codes 

Xi

Hazard Note 

Irritant

HazardClass 

6.1

HS Code 

2908190090

3-Bromo-4-fluorophenol Usage And Synthesis

Uses

3-Bromo-4-fluorophenol is commonly used as a synthetic intermediate for pharmaceutical molecules and bioactive substances, and it has wide applications in the preparation of bactericides and preservatives. Synthetic transformations mainly revolve around the bromine unit in its structure; the bromine atom can be linked to aryl, alkyl, etc., via the Suzuki coupling reaction. Furthermore, the phenolic hydroxyl group undergoes alkylation under basic conditions to yield ether compounds.

Chemical Properties

off-white to light yellow crystalline

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