4-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid


Chemical Name: 4-chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid
CAS Number: 1211583-37-7
Product Number: AG009Y9D(AGN-PC-09R4JP)
Synonyms:
MDL No:
Molecular Formula: C8H5ClN2O2
Molecular Weight: 196.5905

Identification/Properties


Computed Properties
Molecular Weight:
196.59g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
196.004g/mol
Monoisotopic Mass:
196.004g/mol
Topological Polar Surface Area:
66A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
224
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



4-Chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid is a versatile compound widely utilized in chemical synthesis. This compound serves as a crucial building block in the development of various pharmaceuticals, agrochemicals, and materials. Due to its unique structure and reactivity, 4-Chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid is particularly valuable in the synthesis of heterocyclic compounds, which are essential in drug discovery and development.The presence of a chloro substituent on the pyrrolopyridine ring confers specific properties to the molecule, allowing for selective derivatization and modification in synthetic pathways. This compound can act as a key intermediate in the production of biologically active molecules such as kinase inhibitors, antibiotics, and antiviral agents. Additionally, the carboxylic acid group on the pyridine ring provides a handle for further functionalization and coupling reactions, enabling the synthesis of complex molecular structures.In summary, the application of 4-Chloro-1H-pyrrolo[2,3-b]pyridine-2-carboxylic acid in chemical synthesis lies in its ability to serve as a pivotal building block for the construction of diverse heterocyclic compounds with significant biological and pharmacological relevance.