5-bromo-4-chloropyridine-2-carboxylic acid


Chemical Name: 5-bromo-4-chloropyridine-2-carboxylic acid
CAS Number: 1060802-25-6
Product Number: AG007VWY(AGN-PC-0CDARL)
Synonyms:
MDL No:
Molecular Formula: C6H3BrClNO2
Molecular Weight: 236.4505

Identification/Properties


Computed Properties
Molecular Weight:
236.449g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
234.904g/mol
Monoisotopic Mass:
234.904g/mol
Topological Polar Surface Area:
50.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
167
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



5-Bromo-4-chloropicolinic acid is a versatile chemical compound widely used in chemical synthesis due to its unique properties and reactivity. This compound serves as a key building block in the creation of various pharmaceuticals, agrochemicals, and materials.One of the primary applications of 5-Bromo-4-chloropicolinic acid is in the synthesis of complex organic molecules. It acts as a valuable intermediate in the formation of heterocyclic compounds, which are essential in drug discovery and development. The presence of both bromine and chlorine atoms in its structure facilitates diverse functional group transformations, allowing for the introduction of different chemical moieties with precision.Furthermore, 5-Bromo-4-chloropicolinic acid is often utilized in transition metal-catalyzed cross-coupling reactions to create carbon-carbon and carbon-heteroatom bonds. By serving as a ligand or a coupling partner, this compound enables the construction of intricate molecular frameworks with high efficiency and selectivity. Its compatibility with various reaction conditions and catalyst systems makes it a valuable tool in the synthesis of organic molecules with specific biological or industrial applications.In summary, the strategic incorporation of 5-Bromo-4-chloropicolinic acid in chemical synthesis enables the synthesis of structurally diverse and complex compounds with immense potential in the fields of medicine, agriculture, and materials science. Its versatile properties make it an indispensable component in the toolkit of synthetic chemists aiming to access novel molecules with tailored properties and functionalities.