4-Bromo-1-fluoro-2-methylbenzene

Basic Information

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CAS Number

51437-00-4

Molecular Formula

C7H6BrF

Molecular Weight

189.03 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Boiling Point

94-95 ºC (50 mmHg)

Refractive Index

n20/D 1.529(lit.)

SMILES

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

InChI

InChI=1S/C7H6BrF/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H3

InChIKey

VXKYOKPNAXNAFU-UHFFFAOYSA-N

LogP

2.8966200000000004

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

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

Synonyms & References

English

CS-W015978
W-105893
DTXSID90199412
5-bromo-2-fluoro toluene
4-Bromo-1-fluoro-2-methylbenzene #
5-Bromo-2-fluorotoluene
MFCD00000343
SCHEMBL13470
SY016326
EN300-28933
5-Bromo-2-fluorotoluene, 97%
A7584
InChI=1/C7H6BrF/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H
51437-00-4
B1679
AC7936
5-Bromo-2-fluoro-toluene
Benzene, 4-bromo-1-fluoro-2-methyl-
4-Bromo-1-fluoro-2-methylbenzene
2-Fluoro-5-Bromotoluene
4-bromo-1-fluoro-2-methyl-benzene
2-fluoro-5-bromo-toluene
AKOS000121867
EINECS 257-202-9
FT-0620092
AM62016
NS00056515
AC-6886
2-Fluoro-5-bromotoluene
1-bromo-4-fluoro-3-methylbenzene
4-fluoro-3-methyl-1-bromo-benzene

MDL Number

MFCD00000343

Customs Code

29036990

FAQ

What is 4-Bromo-1-fluoro-2-methylbenzene (CAS: 51437-00-4)?

4-Bromo-1-fluoro-2-methylbenzene is an organic compound with the chemical formula C<sub>7</sub>H<sub>6</sub>BrF. It is a benzene derivative with a 4-bromo, 1-fluoro, and 2-methyl substituent. This compound is characterized by its aromatic ring structure and contains a bromine atom and a fluorine atom, making it a halobenzene with specific physical and chemical properties.

What are the main uses of 4-Bromo-1-fluoro-2-methylbenzene (CAS: 51437-00-4)?

4-Bromo-1-fluoro-2-methylbenzene is primarily used in pharmaceutical research and synthesis due to its unique functional groups. It serves as a precursor in the development of certain drugs and can be used in organic synthesis for the preparation of other halobenzenes or substituted benzene derivatives. Additionally, it may find applications in materials science and as an intermediate in chemical manufacturing processes.

Is 4-Bromo-1-fluoro-2-methylbenzene (CAS: 51437-00-4) safe?

4-Bromo-1-fluoro-2-methylbenzene can be toxic and requires proper handling. It is important to store and use this compound in a well-ventilated area and with appropriate personal protective equipment (PPE), such as gloves and goggles. Exposure to the skin, inhalation, or ingestion should be avoided. Follow safety guidelines and use in a controlled environment to minimize risks.

How should 4-Bromo-1-fluoro-2-methylbenzene (CAS: 51437-00-4) be stored?

4-Bromo-1-fluoro-2-methylbenzene should be stored in a tightly sealed container in a cool, dry place away from direct sunlight and heat sources. It should be kept at room temperature or below, ideally in a refrigerator to prevent degradation. Avoid storing it in humid conditions or near flammable materials. The container should be clearly labeled with its CAS number and contents to ensure proper identification and handling.