2-Fluoro-1-methyl-3-(trifluoromethyl)benzene

Basic Information

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CAS Number

1214331-63-1

Molecular Formula

C8H6F4

Molecular Weight

178.13 g/mol

Chemical Classification

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

SMILES

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

InChI

InChI=1S/C8H6F4/c1-5-3-2-4-6(7(5)9)8(10,11)12/h2-4H,1H3

InChIKey

JQJROTAJVIREBJ-UHFFFAOYSA-N

LogP

3.152920000000001

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

152

Synonyms & References

English

2-Fluoro-1-methyl-3-(trifluoromethyl)benzene
2-Fluoro-3-trifluoromethyltoluene
2-fluoro-1-methyl-3-(trifluoromethyl)benzene
AKOS015890544
2-Fluoro-3-methylbenzotrifluoride
MFCD13185663
DFIWLUFOIKBHKO-UHFFFAOYSA-N
CL8820
SCHEMBL476650
DTXSID30591512
JQJROTAJVIREBJ-UHFFFAOYSA-N
CS-0442441
2-Fluoro-3-(Trifluoromethyl)Toluene
Benzene, 2-fluoro-1-methyl-3-(trifluoromethyl)-
2-Fluoro-1-methyl-3-trifluoromethyl-benzene
DB-011017
1214331-63-1
AS-46113

MDL Number

MFCD13185663

FAQ

What regulatory guidelines apply to 2-Fluoro-1-methyl-3-(trifluoromethyl)benzene (CAS: 1214331-63-1)?

2-Fluoro-1-methyl-3-(trifluoromethyl)benzene (CAS: 1214331-63-1) is regulated under the Globally Harmonized System of Classification and Labeling of Chemicals (GHS), REACH regulations in the European Union, and FDA and EPA guidelines in the United States. It is classified as a hazardous substance due to its flammability and potential for skin and eye irritation. Companies must comply with these regulations for storage, transportation, and disposal to ensure safety and environmental protection.

Are there alternatives to 2-Fluoro-1-methyl-3-(trifluoromethyl)benzene (CAS: 1214331-63-1) in synthesis?

While 2-Fluoro-1-methyl-3-(trifluoromethyl)benzene (CAS: 1214331-63-1) is a versatile compound, alternatives such as 2-chloro-1-methyl-3-(trifluoromethyl)benzene or 2,4,6-trifluoromethylbenzene can be used in synthesis. These alternatives may have different reactivity profiles and can be chosen based on the specific requirements of the reaction or the desired product properties.

What is the market or research trend for 2-Fluoro-1-methyl-3-(trifluoromethyl)benzene (CAS: 1214331-63-1)?

The market for 2-Fluoro-1-methyl-3-(trifluoromethyl)benzene (CAS: 1214331-63-1) is growing due to its use in pharmaceuticals and fine chemicals. Research trends focus on its applications in drug discovery and development, particularly as intermediates in the synthesis of bioactive compounds. Market trends indicate increasing demand in the pharmaceutical industry, driven by the need for innovative and effective therapeutic agents.

How should waste containing 2-Fluoro-1-methyl-3-(trifluoromethyl)benzene (CAS: 1214331-63-1) be handled?

Waste containing 2-Fluoro-1-methyl-3-(trifluoromethyl)benzene (CAS: 1214331-63-1) should be collected in a sealed container and disposed of through a licensed waste management facility. Proper incineration or chemical treatment is recommended to ensure complete degradation. Environmental precautions include the use of appropriate personal protective equipment (PPE) and adherence to local and national waste disposal regulations to prevent environmental contamination.