5-Methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde


Chemical Name: 5-Methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde
CAS Number: 1190321-17-5
Product Number: AG000HZ4(AGN-PC-022ZOL)
Synonyms:
MDL No:
Molecular Formula: C9H8N2O
Molecular Weight: 160.1726

Identification/Properties


Computed Properties
Molecular Weight:
160.176g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
160.064g/mol
Monoisotopic Mass:
160.064g/mol
Topological Polar Surface Area:
45.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
183
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:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



5-Methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde holds a significant role in chemical synthesis as a versatile building block. Its unique molecular structure provides opportunities for diverse functionalization and modification in organic reactions. The aldehyde group in this compound serves as a crucial moiety for the formation of various chemical bonds through condensation reactions, such as the classic aldol and Mannich reactions. Additionally, the pyrrolopyridine backbone offers a valuable scaffold for the construction of complex heterocyclic compounds with potential biological activities.In synthetic chemistry, 5-Methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde can be utilized for the synthesis of pharmaceutical intermediates, agrochemicals, and materials with tailored properties. Through functional group transformations and strategic derivatization, this compound enables the generation of molecular structures that are challenging to access by other means. Moreover, its presence in the chemical toolbox facilitates the assembly of molecules of interest with precise control over stereochemistry and regioselectivity.The application of 5-Methyl-1H-pyrrolo[2,3-b]pyridine-3-carbaldehyde in chemical synthesis extends beyond routine reactions, offering chemists a platform for innovation and discovery in the molecular design landscape. Its incorporation in synthetic strategies enhances the efficiency and sophistication of organic transformations, opening avenues for the creation of novel compounds with diverse properties and functionalities.