2,6-Dibromophenol

Basic Information

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CAS Number

608-33-3

Molecular Formula

C6H4Br2O

Molecular Weight

251.91 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

53-56 °C

Boiling Point

255-256 °C/740 mmHg

Density

1.8854 (rough estimate)

Water Solubility

Soluble in ethanol and ether. Slightly soluble in water.

Flash Point

255-256℃

Refractive Index

1.5380 (estimate)

SMILES

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

InChI

InChI=1S/C6H4Br2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9H

InChIKey

SSIZLKDLDKIHEV-UHFFFAOYSA-N

LogP

2.9172000000000002

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

87.1

Safety Information

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Hazard Statement

Hazard Class

Class 6.1(b) Class 6.1(b)

Synonyms & References

English

608-33-3
2,6-DIBROMOPHENOL
NSC-6214
2,6-dibromo-pheno
NSC6214
MFCD00002152
FT-0610560
W-105226
2,6-Dibromophenol, analytical standard
CS-W009153
27MIP05EAV
2,6-DIBROMOPHENOL [HSDB]
A19919
AC-23653
59779-25-8
2,6-Dibromo-phenol
Phenol, 2,6-dibromo-; 2,6-Dibromophenol; NSC 6214
HSDB 7652
PD158453
InChI=1/C6H4Br2O/c7-4-2-1-3-5(8)6(4)9/h1-3,9
DTXSID0060561
EN300-29657
Z285522740
HY-Y1667
NSC 6214
2,6-Dibromophenol, 99%
CHEMBL111507
AJ-087/41885654
AKOS009152462
2,6-dibromo phenol
2,6-Bis(Bromanyl)phenol

MDL Number

MFCD00002152

Customs Code

29081000

FAQ

What are the physical and chemical properties of 2,6-Dibromophenol (CAS: 608-33-3)?

2,6-Dibromophenol (CAS: 608-33-3) is a crystalline solid with a molecular weight of approximately 260.03 g/mol. It has a high solubility in organic solvents like methanol, ethanol, and acetone, but is poorly soluble in water. Chemically, it is highly reactive due to the presence of bromine groups, making it prone to substitution reactions and other transformations.

How is 2,6-Dibromophenol (CAS: 608-33-3) typically synthesized?

2,6-Dibromophenol is typically synthesized by the reaction of phenol with bromine in an aqueous medium. Common methods include the direct bromination of phenol using bromine in the presence of a catalyst, such as ferric bromide. The reaction is typically carried out at room temperature, and the yield can be improved by using excess bromine and maintaining good mixing conditions to ensure high selectivity and yield.

What industries use 2,6-Dibromophenol (CAS: 608-33-3)?

2,6-Dibromophenol (CAS: 608-33-3) is used in various industries, including pharmaceuticals, where it serves as a precursor for the synthesis of certain drugs. It is also used in the production of dyes, as a photoreactive agent in polymers, and in the development of sensors and semiconductors due to its unique bromine-containing structure.

What precautions should be taken when handling 2,6-Dibromophenol (CAS: 608-33-3)?

When handling 2,6-Dibromophenol (CAS: 608-33-3), it is crucial to use appropriate personal protective equipment (PPE) such as gloves, goggles, and lab coats. Work should be conducted in a well-ventilated area or a fume hood due to its volatility and reactivity. In case of a spill, immediately clean it up using appropriate materials and ensure proper disposal. Always refer to the Material Safety Data Sheet (MSDS) for detailed handling and safety information.