3-Bromo-6-chloro-2-(trifluoromethyl)pyridine

Basic Information

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CAS Number

1227563-63-4

Molecular Formula

C6H2BrClF3N

Molecular Weight

260.44 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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C1=CC(=NC(=C1Br)C(F)(F)F)Cl

InChI

InChI=1S/C6H2BrClF3N/c7-3-1-2-4(8)12-5(3)6(9,10)11/h1-2H

InChIKey

XLYJYRSSHPLAGP-UHFFFAOYSA-N

LogP

3.5163

Topological Polar Surface Area

12.89 Å²

Hydrogen Bond Donor/Acceptor

0 / 1

Complexity

163

Synonyms & References

English

3-Bromo-6-chloro-2-(trifluoromethyl)pyridine
3-bromo-6-chloro-2-(trifluoromethyl)pyridine
1227563-63-4
XLYJYRSSHPLAGP-UHFFFAOYSA-N
AKOS022176121
AMY3156
CS-W006915
SCHEMBL20796970
SY035556
A891004
Pyridine, 3-bromo-6-chloro-2-(trifluoromethyl)-
DTXSID20858621
SB21121
EN300-6480509
MFCD16609904
AS-32940
DB-252396

MDL Number

MFCD16609904

FAQ

What are the physical and chemical properties of 3-Bromo-6-chloro-2-(trifluoromethyl)pyridine (CAS: 1227563-63-4)?

3-Bromo-6-chloro-2-(trifluoromethyl)pyridine is a crystalline compound with a molecular weight of approximately 304.01 g/mol. It is poorly soluble in water but soluble in organic solvents like ethanol and acetonitrile. The compound is known for its high reactivity, particularly towards nucleophilic substitution reactions.

How is 3-Bromo-6-chloro-2-(trifluoromethyl)pyridine (CAS: 1227563-63-4) typically synthesized?

3-Bromo-6-chloro-2-(trifluoromethyl)pyridine is typically synthesized via a series of electrophilic aromatic substitution reactions. Common methods include the halogenation of pyridine derivatives using bromine or chlorine, followed by the introduction of a trifluoromethyl group using a trifluoromethylating agent like trifluoromethanesulfonyl chloride (TFSCl) in the presence of a base.

What industries use 3-Bromo-6-chloro-2-(trifluoromethyl)pyridine (CAS: 1227563-63-4)?

3-Bromo-6-chloro-2-(trifluoromethyl)pyridine is used in the pharmaceutical industry for its potential as a precursor in synthesizing bioactive molecules. It also finds applications in the polymer industry for functional polymer synthesis and as a precursor in semiconductor manufacturing processes.

What precautions should be taken when handling 3-Bromo-6-chloro-2-(trifluoromethyl)pyridine (CAS: 1227563-63-4)?

Proper personal protective equipment (PPE) such as gloves, goggles, and a lab coat is essential when handling 3-Bromo-6-chloro-2-(trifluoromethyl)pyridine. It should be stored in a well-ventilated area or in a fume hood to minimize exposure. In case of spill, it is crucial to follow the safety data sheet (SDS) guidelines and use appropriate cleanup materials. Always work under the guidance of a qualified chemist or lab technician.