4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene

Basic Information

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CAS Number

105529-58-6

Molecular Formula

C7H3BrF4O

Molecular Weight

259 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

No data available

Boiling Point

175.3°C at 760 mmHg

Flash Point

72.5±10.2 °C

Refractive Index

1.4470

SMILES

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C1=CC(=C(C=C1Br)F)OC(F)(F)F

InChI

InChI=1S/C7H3BrF4O/c8-4-1-2-6(5(9)3-4)13-7(10,11)12/h1-3H

InChIKey

SBSFDYRKNUCGBZ-UHFFFAOYSA-N

LogP

3.4867999999999997

Topological Polar Surface Area

9.23 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

172

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

Synonyms & References

English

1-bromo-3-fluoro-4-(trifluoromethoxy)benzene
3-fluoro-4-trifluoromethoxy bromobenzene
3-fluoro-4-trifluoromethoxyphenylbromide
DTXSID20381984
PS-7378
3-Fluoro-4-(trifluoromethoxy)bromobenzene
105529-58-6
4-bromo-2-fluoro-1-(trifluoromethoxy)benzene
FT-0642599
3-fluoro-4-trifluoromethoxybromobenzene
CS-W002836
SY020764
AKOS005063470
Benzene, 4-bromo-2-fluoro-1-(trifluoromethoxy)-
FT-0654400
4-Bromo-2-fluoro-1-trifluoromethoxybenzene
EN300-142179
A1990
AC-13879
B3808
J-504423
AM61275
NS00001121
4-Bromo-2-fluoro(trifluoromethoxy)benzene
SCHEMBL425877
MFCD01861132
4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene
-4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene
4-(Trifluoromethoxy)-3-fluorobromobenzene
1-Brom-3-fluor-4-trifluormethoxybenzol
2-Fluoro-4-bromotrifluoromethoxybenzene

MDL Number

MFCD01861132

Customs Code

2909309090

FAQ

What regulatory guidelines apply to 4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene (CAS: 105529-58-6)?

4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene (CAS: 105529-58-6) falls under the scope of the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) and is regulated by the REACH regulations in the European Union. Additionally, it is subject to FDA/EPA requirements for handling and disposal. Manufacturers and importers must ensure proper labeling, safety data sheets (SDS), and comply with environmental protection measures.

Are there alternatives to 4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene (CAS: 105529-58-6) in synthesis?

Alternatives to 4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene include other brominated and halogenated benzene derivatives. Common substitutes in synthesis include 4-Chloro-2-fluoro-1-(trifluoromethoxy)benzene and 4-Iodo-2-fluoro-1-(trifluoromethoxy)benzene. These alternatives offer similar functional groups but with different halogen substitutions.

What is the market or research trend for 4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene (CAS: 105529-58-6)?

The market for 4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene is driven by its use in pharmaceuticals, agrochemicals, and certain specialty chemical applications. Research trends focus on its application in drug synthesis and as a key intermediate in the development of new materials. Recent studies highlight increased demand in the pharmaceutical industry due to its unique chemical properties.

How should waste containing 4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene (CAS: 105529-58-6) be handled?

Waste containing 4-Bromo-2-fluoro-1-(trifluoromethoxy)benzene should be collected in appropriate containers and disposed of through incineration or other professional waste disposal methods. Environmental protection measures include ensuring no release into the environment and proper documentation of waste management procedures. Compliance with local regulations and standards is crucial for safe disposal of this compound.