2-Bromo-1,4-bis(trifluoromethyl)benzene

Basic Information

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CAS Number

7617-93-8

Molecular Formula

C8H3BrF6

Molecular Weight

293 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

5°C

Boiling Point

158°C

Density

1.691 g/mL at 25 °C

Flash Point

>230 °F

Refractive Index

n20/D >1.4340(lit.)

SMILES

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C1=CC(=C(C=C1C(F)(F)F)Br)C(F)(F)F

InChI

InChI=1S/C8H3BrF6/c9-6-3-4(7(10,11)12)1-2-5(6)8(13,14)15/h1-3H

InChIKey

GFQNSGHVOFVTLC-UHFFFAOYSA-N

LogP

4.486700000000001

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

220

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

1,4-bis(trifluoromethyl)-2-bromobenzene
2,5-Bis-trifluoromethylbromobenzene
AS-30446
2,5-bis(trifluoromethyl)phenyl bromide
1-Bromo-2,5-bis(trifluoromethyl)benzene
FT-0610264
AM62095
A9658
B2545
SCHEMBL290533
SY016857
CS-W003003
2,5-Ditrifluoromethylbromobenzene
2-bromo-1,4-bis(trifluoromethyl)benzene
2,5-Bis(trifluoromethyl)bromobenzene, 97%
2,5-Bis(trifluoromethyl)bromobenzene
DTXSID10370488
AC-2301
7617-93-8
2,5-Bis(trifluoromethyl) Bromobenzene
Benzene, 2-bromo-1,4-bis(trifluoromethyl)-
AKOS003587358
MFCD03094336
2-Bromo-1,4-bis(trifluoromethyl)benzene
C8H3BrF6
1,4-BIS(TRIFLUOROMETHYL)-2-BROMOBENZENE
2,4-DICHLORO-5-NITROPHENYL ISOPROPYL-D7 ETHER
2,5-Bis(Trifluoromethyl) Bromobenzene 2,5-Bis(Trifluoromethyl)Bromobenzene
2-Brom-1,4-bis-trifluormethyl-benzol
2-bromo-1,4-bis-(trifluoromethyl)-benzene
2-BroMo-5-fluorotoluene

MDL Number

MFCD03094336

Customs Code

2903999090

FAQ

What are the physical and chemical properties of 2-Bromo-1,4-bis(trifluoromethyl)benzene (CAS: 7617-93-8)?

2-Bromo-1,4-bis(trifluoromethyl)benzene is a colorless or light yellow crystalline solid. Its molecular weight is approximately 318.07 g/mol. It is poorly soluble in water but soluble in organic solvents such as dichloromethane and acetonitrile. It is highly reactive towards nucleophiles and can undergo substitution reactions. It is a dense, volatile liquid at room temperature.

How is 2-Bromo-1,4-bis(trifluoromethyl)benzene (CAS: 7617-93-8) typically synthesized?

2-Bromo-1,4-bis(trifluoromethyl)benzene is typically synthesized by bromination of 1,4-bis(trifluoromethyl)benzene in the presence of a Lewis acid catalyst, such as aluminum trichloride. The reaction is carried out in anhydrous conditions and yields up to 90% of the product. The reaction is selective and provides good yield under optimized conditions.

What industries use 2-Bromo-1,4-bis(trifluoromethyl)benzene (CAS: 7617-93-8)?

2-Bromo-1,4-bis(trifluoromethyl)benzene is used in the pharmaceutical industry for the synthesis of certain pharmaceutical compounds. It is also utilized in the polymer industry for preparing functional polymers with enhanced properties. Additionally, it is used in the semiconductor and sensor industries for specific applications due to its unique chemical structure.

What precautions should be taken when handling 2-Bromo-1,4-bis(trifluoromethyl)benzene (CAS: 7617-93-8)?

When handling 2-Bromo-1,4-bis(trifluoromethyl)benzene, it is essential to wear appropriate personal protective equipment (PPE) including gloves, safety goggles, and a laboratory coat. Work should be conducted in a well-ventilated area or a fume hood. Spills should be cleaned up immediately with appropriate absorbents. Always refer to the Material Safety Data Sheet (MSDS) for detailed safety information and follow all laboratory safety guidelines.