2-Bromo-4-methylphenol

Basic Information

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CAS Number

6627-55-0

Molecular Formula

C7H7BrO

Molecular Weight

187.04 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

213-214 °C

Boiling Point

214°C

Density

1.547 g/mL at 25 °C

Water Solubility

Slightly soluble in water.

Refractive Index

n20/D 1.578(lit.)

SMILES

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CC1=CC(=C(C=C1)O)Br

InChI

InChI=1S/C7H7BrO/c1-5-2-3-7(9)6(8)4-5/h2-4,9H,1H3

InChIKey

MTIDYGLTAOZOGU-UHFFFAOYSA-N

LogP

2.46312

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

94.9

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class IRRITANT Class IRRITANT

Sensitiveness

Sensitive to air

Synonyms & References

English

3-Bromo-4-hydroxytoluene
F16568
AKOS000121426
2-Bromo-4-methylphenol
MFCD00002151
UNII-U7N9MXC7HG
AC-25967
2-Bromo-p-cresol
NSC60115
EINECS 229-595-7
A19037
HY-W016153
NSC 60115
4-06-00-02143 (Beilstein Handbook Reference)
2-Bromo-4-methylphenol, 96%
DTXSID8074574
AM20040978
NS00035997
FT-0611590
p-Cresol, 2-bromo- (6CI,7CI,8CI); 2-Bromo-4-methylphenol; 2-Bromo-4-cresol; 2-Bromo-p-cresol; 3-Bromo-4-hydroxytoluene; NSC 60115
2-bromo-4-methyl phenol
SY049117
EN300-20031
SCHEMBL358697
CS-W016869
PB43240
PS-8466
BB 0262339
2-bromo-4-methyl-phenol
6627-55-0
B0808

MDL Number

MFCD00002151

Customs Code

2908199090

FAQ

What are the physical and chemical properties of 2-Bromo-4-methylphenol (CAS: 6627-55-0)?

2-Bromo-4-methylphenol (CAS: 6627-55-0) is a white crystalline solid with a molecular weight of approximately 186.03 g/mol. It has a density of about 1.33 g/cm³ and is slightly soluble in water. It is known for its strong reactivity towards nucleophiles and electrophiles. The compound is also susceptible to hydrolysis under basic conditions.

How is 2-Bromo-4-methylphenol (CAS: 6627-55-0) typically synthesized?

2-Bromo-4-methylphenol (CAS: 6627-55-0) is typically synthesized by bromination of 4-methylphenol using bromine in the presence of a base like sodium hydroxide. The reaction is exothermic and requires careful control to achieve the desired product with high selectivity and yield.

What industries use 2-Bromo-4-methylphenol (CAS: 6627-55-0)?

2-Bromo-4-methylphenol (CAS: 6627-55-0) is used in various industries including pharmaceuticals for the synthesis of certain drugs, in polymers for modifying their properties, and in sensors as a functional component. It is also utilized in the production of semiconductors and as an intermediate in the chemical industry.

What precautions should be taken when handling 2-Bromo-4-methylphenol (CAS: 6627-55-0)?

When handling 2-Bromo-4-methylphenol (CAS: 6627-55-0), it is essential to use personal protective equipment (PPE) such as gloves, goggles, and a lab coat. Work should be conducted in a well-ventilated area or a fume hood to minimize exposure. Spills should be cleaned up immediately with appropriate absorbents. The Safety Data Sheet (SDS) should be consulted for detailed handling and disposal instructions.