1-Fluoro-4-(trichloromethyl)benzene

Basic Information

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CAS Number

402-42-6

Molecular Formula

C7H4Cl3F

Molecular Weight

213.47 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Boiling Point

218.7°C at 760 mmHg

Flash Point

95.9°C

Refractive Index

1.534

SMILES

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C1=CC(=CC=C1C(Cl)(Cl)Cl)F

InChI

InChI=1S/C7H4Cl3F/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4H

InChIKey

XOJYLEJZALFLLW-UHFFFAOYSA-N

LogP

3.6524

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

124

Safety Information

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Hazard Statement

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

N6PPN85NHB
NS00043747
4-Fluoro benzotrichloride
NSC 10310
EINECS 206-942-0
1-fluoro-4-(trichloromethyl)benzene
Benzene, 1-fluoro-4-(trichloromethyl)-
402-42-6
p-Fluoro-alpha,alpha,alpha-trichlorotoluene
NSC10310
SCHEMBL3158793
MFCD00018822
p-Fluorobenzotrichloride
UNII-N6PPN85NHB
4-Fluorobenzotrichloride
F87351
AKOS016011075
DTXSID10193194
XOJYLEJZALFLLW-UHFFFAOYSA-N
A825001
NSC-10310
p-Fluoro-.alpha.,.alpha.,.alpha.-trichlorotoluene
FT-0618514
p-Fluoro-.alpha.,.alpha.,.alpha.- trichlorotoluene
1-Fluoro-4-(trichloromethyl)benzene
4-Fluoro-alpha,alpha,alpha-trichlorotoluene
p-Fluoro-α,α,α-trichlorotoluene

MDL Number

MFCD00018822

Customs Code

2903999090

FAQ

What regulatory guidelines apply to 1-Fluoro-4-(trichloromethyl)benzene (CAS: 402-42-6)?

1-Fluoro-4-(trichloromethyl)benzene (CAS: 402-42-6) falls under the classification of a toxic and hazardous substance under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS). It is also subject to reporting requirements under REACH regulations in the EU, and may be regulated by the FDA and EPA for its specific uses in the United States. Safe handling and disposal practices must be followed to minimize environmental and health risks.

Are there alternatives to 1-Fluoro-4-(trichloromethyl)benzene (CAS: 402-42-6) in synthesis?

Alternative reagents such as 1-Chloro-4-(trichloromethyl)benzene can be considered as substitutes in synthesis, depending on the specific reaction and desired product. Other alternatives may include using less reactive or less hazardous precursors, but it is important to consider the compatibility with the reaction conditions and the final application.

What is the market or research trend for 1-Fluoro-4-(trichloromethyl)benzene (CAS: 402-42-6)?

The research and market trend for 1-Fluoro-4-(trichloromethyl)benzene (CAS: 402-42-6) remains niche due to its use in specialized chemical processes. However, there is ongoing exploration into its potential applications in novel organic syntheses and as a component in advanced materials. Market trends suggest a steady demand but with a focus on safer and more sustainable alternatives.

How should waste containing 1-Fluoro-4-(trichloromethyl)benzene (CAS: 402-42-6) be handled?

Waste containing 1-Fluoro-4-(trichloromethyl)benzene (CAS: 402-42-6) should be collected in appropriate containers, labeled clearly, and stored in a secure and well-ventilated area. Incineration under controlled conditions is preferred, or professional waste disposal services should be utilized to ensure safe and environmentally friendly disposal. Proper environmental protection measures, such as the use of personal protective equipment and adherence to local regulations, must be strictly followed.