structure of 2-Bromo-3-chloropyridine-4-boronic acid

2-Bromo-3-chloropyridine-4-boronic acid

CAS No.: 1003043-31-9
M. Wt: 236.25900
M. Fa: C5H4BBrClNO2
InChI Key: XBFYDECHVMPQHV-UHFFFAOYSA-N
Appearance: Off white solid

Names and Identifiers of 2-Bromo-3-chloropyridine-4-boronic acid

CAS Number

1003043-31-9

MDL Number

MFCD08690231

IUPAC Name

(2-bromo-3-chloropyridin-4-yl)boronic acid

InChI

InChI=1S/C5H4BBrClNO2/c7-5-4(8)3(6(10)11)1-2-9-5/h1-2,10-11H

InChIKey

XBFYDECHVMPQHV-UHFFFAOYSA-N

Canonical SMILES

B(C1=C(C(=NC=C1)Br)Cl)(O)O

UNSPSC Code

12352100

Physical and chemical properties of 2-Bromo-3-chloropyridine-4-boronic acid

Boiling Point

399.9ºC at 760 mmHg

Density

1.9g/cm3

Exact Mass

234.92100

Flash Point

195.7ºC

LogP

0.17730

Molecular Formula

C5H4BBrClNO2

Molecular Weight

236.25900

PSA

53.35000

Storage condition

Inert atmosphere,Store in freezer, under -20°C

Safety Information of 2-Bromo-3-chloropyridine-4-boronic acid

Pictograms

Signal Word

 Warning

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

Applications of 2-Bromo-3-chloropyridine-4-boronic acid

2-Bromo-3-chloropyridine-4-boronic acid finds applications in various fields:

  • Pharmaceutical Development: It serves as an important intermediate in the synthesis of biologically active compounds, including potential drugs targeting cancer and infectious diseases.
  • Material Science: The compound can be used in the development of new materials through polymerization reactions involving its boronic acid functionality.
  • Agricultural Chemistry: It may also play a role in the synthesis of agrochemicals, enhancing crop protection strategies.

Interaction Studies of 2-Bromo-3-chloropyridine-4-boronic acid

Interaction studies involving 2-Bromo-3-chloropyridine-4-boronic acid focus on its reactivity with various substrates. These studies are crucial for understanding how this compound can be utilized effectively in synthetic pathways and its potential biological interactions. For instance, its interactions with proteins or enzymes could reveal insights into its mechanism of action if developed as a pharmaceutical agent.

Physical sample testing spectrum (NMR) of 2-Bromo-3-chloropyridine-4-boronic acid

Physical sample testing spectrum (NMR) of 2-Bromo-3-chloropyridine-4-boronic acid