structure of 2-Chloropyridine-4-sulfonyl chloride

2-Chloropyridine-4-sulfonyl chloride

CAS No.: 1000933-25-4
M. Wt: 212.054
M. Fa: C5H3Cl2NO2S
InChI Key: YQKSHKJJXUAFAN-UHFFFAOYSA-N
Appearance: Pale-yellow Liquid

Names and Identifiers of 2-Chloropyridine-4-sulfonyl chloride

CAS Number

1000933-25-4

MDL Number

MFCD09971485

IUPAC Name

2-chloropyridine-4-sulfonyl chloride

InChI

InChI=1S/C5H3Cl2NO2S/c6-5-3-4(1-2-8-5)11(7,9)10/h1-3H

InChIKey

YQKSHKJJXUAFAN-UHFFFAOYSA-N

Canonical SMILES

C1=CN=C(C=C1S(=O)(=O)Cl)Cl

UNSPSC Code

12352100

Physical and chemical properties of 2-Chloropyridine-4-sulfonyl chloride

Boiling Point

329.4±27.0 °C at 760 mmHg

Density

1.6±0.1 g/cm3

Exact Mass

210.926147

Flash Point

153.0±23.7 °C

H Bond Acceptors

3

H Bond Donors

0

Index of Refraction

1.569

LogP

1.53

Molecular Formula

C5H3Cl2NO2S

Molecular Weight

212.054

PSA

55.41000

Vapour Pressure

0.0±0.7 mmHg at 25°C

Safety Information of 2-Chloropyridine-4-sulfonyl chloride

Pictograms

Signal Word

Warning

Safety Data Sheet

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

Applications of 2-Chloropyridine-4-sulfonyl chloride

2-Chloropyridine-4-sulfonyl chloride finds applications across various fields:

  • Medicinal Chemistry: It serves as an intermediate in the synthesis of pharmaceuticals, particularly those targeting specific biological pathways.
  • Material Science: Used in developing polymeric materials with tailored properties through functionalization reactions.
  • Biochemical Research: Its ability to modify proteins makes it valuable in proteomics and biochemical assays.

Interaction Studies of 2-Chloropyridine-4-sulfonyl chloride

Interaction studies involving 2-Chloropyridine-4-sulfonyl chloride focus on its reactivity with different nucleophiles and its effects on biological systems. Research indicates that its sulfonyl chloride group can significantly alter the properties of target molecules, affecting their biological activity and stability. Such studies are crucial for understanding how modifications influence drug efficacy and safety.

Biological Activity of 2-Chloropyridine-4-sulfonyl chloride

2-Chloropyridine-4-sulfonyl chloride exhibits biological activity that makes it relevant in pharmaceutical research. It has been studied for its potential as an inhibitor in various biological pathways. For instance, it has shown promise in proteomics research, where it is utilized to modify proteins and peptides for further analysis. Its reactivity allows for selective modifications that can elucidate biological functions and interactions.

Physical sample testing spectrum (NMR) of 2-Chloropyridine-4-sulfonyl chloride

Physical sample testing spectrum (NMR) of 2-Chloropyridine-4-sulfonyl chloride

Retrosynthesis analysis of 2-Chloropyridine-4-sulfonyl chloride

  • Route#1

    Cas:73583-37-6
    Cas:1000933-25-4
  • Route#2

    Cas:14432-12-3
    Cas:1000933-25-4