structure of 4-Bromo-2-(chloromethyl)pyridine

4-Bromo-2-(chloromethyl)pyridine

CAS No.: 1001463-32-6
M. Wt: 206.46800
M. Fa: C6H5BrClN
InChI Key: JJTOQZAHQZOCKN-UHFFFAOYSA-N
Appearance: Yellow to Red Liquid

Names and Identifiers of 4-Bromo-2-(chloromethyl)pyridine

CAS Number

1001463-32-6

EC Number

972-091-3

MDL Number

MFCD13189213

IUPAC Name

4-bromo-2-(chloromethyl)pyridine

InChI

InChI=1S/C6H5BrClN/c7-5-1-2-9-6(3-5)4-8/h1-3H,4H2

InChIKey

JJTOQZAHQZOCKN-UHFFFAOYSA-N

Canonical SMILES

C1=CN=C(C=C1Br)CCl

UNSPSC Code

12352100

Physical and chemical properties of 4-Bromo-2-(chloromethyl)pyridine

Boiling Point

258.615ºC at 760 mmHg

Density

1.632 g/cm3

Exact Mass

204.92900

Flash Point

110.207ºC

H Bond Acceptors

1

H Bond Donors

0

LogP

2.58290

Molecular Formula

C6H5BrClN

Molecular Weight

206.46800

PSA

12.89000

Storage condition

-20°C

Safety Information of 4-Bromo-2-(chloromethyl)pyridine

Pictograms

Signal Word

 Danger

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of 4-Bromo-2-(chloromethyl)pyridine

4-Bromo-2-(chloromethyl)pyridine finds applications in various fields:

  • Pharmaceuticals: Used as an intermediate in synthesizing active pharmaceutical ingredients.
  • Agrochemicals: Plays a role in developing pesticides and herbicides.
  • Materials Science: Employed in creating specialized polymers and ligands for catalysis.

Interaction Studies of 4-Bromo-2-(chloromethyl)pyridine

Studies on 4-Bromo-2-(chloromethyl)pyridine have focused on its interactions with metal ions, which can lead to stable complexes. These interactions are significant for applications in catalysis and materials science. The compound's ability to form coordination complexes enhances its utility in various chemical processes.

Biological Activity of 4-Bromo-2-(chloromethyl)pyridine

Research indicates that 4-Bromo-2-(chloromethyl)pyridine exhibits biological activity, particularly in pharmacological applications. Its derivatives have been studied for their potential antimicrobial and antifungal properties. The presence of halogen substituents enhances its interaction with biological targets, making it a candidate for drug development.

Physical sample testing spectrum (NMR) of 4-Bromo-2-(chloromethyl)pyridine

Physical sample testing spectrum (NMR) of 4-Bromo-2-(chloromethyl)pyridine

Retrosynthesis analysis of 4-Bromo-2-(chloromethyl)pyridine

  • Route#1

    Cas:22282-99-1
    Cas:1001463-32-6

  • Route#2

    Cas:100367-74-6
    Cas:1001463-32-6