4-Bromo-2,6-difluorobenzonitrile

Basic Information

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CAS Number

123843-67-4

Molecular Formula

C7H2BrF2N

Molecular Weight

207.02 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

79.0 to 83.0 deg-C

SMILES

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C1=C(C=C(C(=C1F)C#N)F)Br

InChI

InChI=1S/C7H2BrF2N/c8-4-1-6(9)5(3-11)7(10)2-4/h1-2H

InChIKey

TZHQWUAOIWRFSW-UHFFFAOYSA-N

LogP

3.0357200000000013

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

176

Safety Information

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GHS Hazard Pictograms

H311

H302

H332

H315

H319

Hazard Statement

H311 Toxic in contact with skin
Acute toxicity, dermal

H302 Harmful if swallowed
Acute toxicity, oral

H332 Harmful if inhaled
Acute toxicity, inhalation

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

CS-W008282
SCHEMBL974652
4-bromanyl-2,6-bis(fluoranyl)benzenecarbonitrile
W-205181
SY020272
DTXSID10373631
MFCD01310981
TZHQWUAOIWRFSW-UHFFFAOYSA-N
EN300-85630
BL007435
AKOS005258003
123843-67-4
1-bromo-4-cyano-3,5-difluoro-benzene
GS-3644
BCP05906
SB66857
AC-4026
A805158
4-Bromo-2,6-difluorobenzonitrile
4-Bromo-2,6-difluoro-bezonitrile
4-Bromo-2,6-difluoro-benzonitrile
4-Bromo-2,6-difluorobenzonitrile, AldrichCPR
FT-0601436
Benzonitrile, 4-bromo-2,6-difluoro-
AM20020321
2,6-difluoro-4-bromobenzonitrile
4-BROMO-2,6-DIFLUOROANILINE
Benzonitrile,4-bromo-2,6-difluoro-
4-bromo-2,6-difluorobenzenecarbonitrile

MDL Number

MFCD01310981

Customs Code

2926909090

FAQ

What regulatory guidelines apply to 4-Bromo-2,6-difluorobenzonitrile (CAS: 123843-67-4)?

4-Bromo-2,6-difluorobenzonitrile (CAS: 123843-67-4) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS), covering health, environmental, and physical hazards. It is also subject to REACH regulations in the European Union, which require registration, evaluation, authorization, and restriction of chemicals. The FDA and EPA may have specific requirements for the handling and disposal of this compound, particularly in the context of pharmaceutical or industrial applications.

Are there alternatives to 4-Bromo-2,6-difluorobenzonitrile (CAS: 123843-67-4) in synthesis?

Yes, there are alternatives to 4-Bromo-2,6-difluorobenzonitrile (CAS: 123843-67-4) in synthesis. For example, 2,6-difluorobenzonitrile can be brominated using other halogenation agents. Common alternatives include using bromine in the presence of a Lewis acid catalyst or employing brominating reagents like N-bromosuccinimide (NBS) with radical initiators. These alternatives can provide similar functional groups but with varying reaction conditions and selectivities.

What is the market or research trend for 4-Bromo-2,6-difluorobenzonitrile (CAS: 123843-67-4)?

The market for 4-Bromo-2,6-difluorobenzonitrile (CAS: 123843-67-4) is driven by its use in pharmaceuticals, organic synthesis, and functional materials. Research trends focus on its application in the development of new drugs and materials. There is an increasing interest in its use as a building block for synthesizing complex molecules and in the field of medicinal chemistry. Market trends suggest a steady demand, with potential for growth in emerging markets and industries.

How should waste containing 4-Bromo-2,6-difluorobenzonitrile (CAS: 123843-67-4) be handled?

Waste containing 4-Bromo-2,6-difluorobenzonitrile (CAS: 123843-67-4) should be collected in appropriate containers and stored separately to prevent contamination. It should be neutralized or treated to reduce its hazardous properties before disposal. Incineration is a common method for disposal, especially in industrial settings, where the waste is treated in a regulated incinerator. For safer disposal, professional hazardous waste management services should be utilized to ensure compliance with local, national, and international regulations regarding hazardous waste management and disposal.