5-Bromo-1H-pyrazolo[3,4-b]pyridine-3-carbaldehyde


Chemical Name: 5-Bromo-1H-pyrazolo[3,4-b]pyridine-3-carbaldehyde
CAS Number: 916326-37-9
Product Number: AG00IGSX(AGN-PC-0WAMJ2)
Synonyms:
MDL No: MFCD11100580
Molecular Formula: C7H4BrN3O
Molecular Weight: 226.0302

Identification/Properties


Computed Properties
Molecular Weight:
226.033g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
224.954g/mol
Monoisotopic Mass:
224.954g/mol
Topological Polar Surface Area:
58.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
190
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

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Chemical Structure



5-Bromo-1H-pyrazolo[3,4-b]pyridine-3-carbaldehyde is a versatile compound widely utilized in chemical synthesis due to its unique structural properties and reactivity. This compound serves as a valuable building block in the development and modification of various organic molecules, particularly in the pharmaceutical and agrochemical industries.One of the key applications of 5-Bromo-1H-pyrazolo[3,4-b]pyridine-3-carbaldehyde is its role as a key intermediate in the synthesis of heterocyclic compounds. Its functional groups and heterocyclic core allow for diverse transformations through a variety of chemical reactions, such as nucleophilic substitution, condensation, and reductive processes. This enables the creation of complex molecular structures with specific biological activities or physical properties.Moreover, the presence of the bromo-substituent in 5-Bromo-1H-pyrazolo[3,4-b]pyridine-3-carbaldehyde offers an additional handle for further derivatization, making it a valuable starting material for the introduction of various functional groups or structural modifications. This versatility allows for the synthesis of novel compounds with enhanced pharmacological or chemical properties for a wide range of applications.Overall, the strategic incorporation of 5-Bromo-1H-pyrazolo[3,4-b]pyridine-3-carbaldehyde in chemical synthesis facilitates the development of diverse molecular architectures with potential applications in drug discovery, materials science, and other fields that require the design of specialized organic compounds.