2-Bromo-6-methylphenol

Basic Information

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CAS Number

13319-71-6

Molecular Formula

C7H7BrO

Molecular Weight

187.04 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

16°C

Boiling Point

208°C

Flash Point

Not available

Refractive Index

1.5680-1.5720

Vapor Pressure

Not available

SMILES

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

InChI

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

InChIKey

YXZPTVOCJLCMRO-UHFFFAOYSA-N

LogP

2.4631200000000013

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

94.9

Safety Information

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Hazard Statement

H227 Combustible liquid
Flammable liquids

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

6-BROMO-O-CRESOL2-BROMO-6-METHYLPHENOL
A888172
CS-0044784
13319-71-6
SY053250
YXZPTVOCJLCMRO-UHFFFAOYSA-N
DTXSID50454993
Phenol, 2-bromo-6-methyl-
SCHEMBL165286
6-Bromo-o-cresol
AKOS015891367
MFCD09907876
2-Bromo-6-methylphenol
J-518451
2-bromo-6-methyl phenol
B3126
6-bromo-2-methylphenol
AC-27864
AM86512
EN300-82648
FT-0697566
Phenol,2-bromo-6-methyl-
6-BroMo-o-cresol,2-BroMo-6-Methylphenol
3-Bromo-2-hydroxytoluene, 6-Bromo-o-cresol
2-Bromo-6-methylphenol96%
2-Bromo-6-methylphenol 96%
RP24696
OR40668
FCH1123112
AB0034045
AX8164357

MDL Number

MFCD09907876

FAQ

What are the physical and chemical properties of 2-Bromo-6-methylphenol (CAS: 13319-71-6)?

2-Bromo-6-methylphenol (CAS: 13319-71-6) is a white crystalline solid with a molecular weight of approximately 192.02 g/mol. It is slightly soluble in water and more soluble in organic solvents like ethanol and acetone. Chemically, it is moderately reactive, showing aromatic properties typical of phenols. It is prone to undergo substitution reactions, particularly bromination and oxidation.

How is 2-Bromo-6-methylphenol (CAS: 13319-71-6) typically synthesized?

2-Bromo-6-methylphenol (CAS: 13319-71-6) is typically synthesized by bromination of 6-methylphenol in the presence of a Lewis acid catalyst, such as AlCl3. The reaction involves the electrophilic aromatic substitution of the phenolic hydroxyl group with a bromide ion derived from the Lewis acid. The yield and selectivity are generally good under optimized conditions.

What industries use 2-Bromo-6-methylphenol (CAS: 13319-71-6)?

2-Bromo-6-methylphenol (CAS: 13319-71-6) is used in the pharmaceutical industry for the synthesis of certain medications. It also finds applications in the production of dyes and pigments, as well as in organic synthesis as a valuable intermediate for preparing other brominated compounds.

What precautions should be taken when handling 2-Bromo-6-methylphenol (CAS: 13319-71-6)?

When handling 2-Bromo-6-methylphenol (CAS: 13319-71-6), it is essential to wear appropriate personal protective equipment (PPE), including gloves and safety goggles. This material should be handled in a well-ventilated area or a fume hood to minimize inhalation risks. Spills should be cleaned up using appropriate absorbents, and the area should be thoroughly washed down. Always refer to the safety data sheet (SDS) for specific handling and disposal instructions.