1H-Pyrrolo[2,3-b]pyridine-4-carbonitrile

Name: 1H-Pyrrolo[2,3-b]pyridine-4-carbonitrile
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CAS No. 344327-11-3
Cat. No. CS-B0500
Purity≥95%
MDL No.MFCD08272235

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Excepted Quantity	$0.00
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1H-Pyrrolo[2,3-b]pyridine-4-carbonitrile|CS-B0500

Structure of 344327-11-3

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General Information

CAS No. 344327-11-3
Cat. No. CS-B0500
Purity ≥95%
MDL No. MFCD08272235
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₅N₃
Molecular Weight None
Synonym(s) 4-Cyano-7-azaindole
SMILES N#CC1=C2C(NC=C2)=NC=C1

Description

1H-Pyrrolo[2,3-b]pyridine-4-carbonitrile integrates a nitrogen-rich heterocyclic core with a terminal nitrile group, enabling direct functionalization in transition-metal-catalyzed cross-coupling reactions. This bench-stable scaffold features enhanced electron deficiency at the pyrrolopyridine ring, facilitating efficient incorporation into bioactive molecules and advanced materials.

Application

1H-Pyrrolo[2,3-b]pyridine-4-carbonitrile serves as a versatile heterocyclic building block in medicinal chemistry, enabling efficient access to fused pyrrolopyridine scaffolds. Its nitrile group facilitates downstream functionalization via hydrolysis, reduction, or nucleophilic addition, while the electron-deficient core supports transition-metal-catalyzed coupling reactions. The compound exhibits good bench stability and is compatible with standard purification methods, making it suitable for iterative synthesis campaigns targeting kinase inhibitors and other bioactive molecules.

Safety Information

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GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

TPSA 52.47
LogP 1.43458
H_Acceptors 2
H_Donors 1
Rotatable_Bonds 0

Other Classifications

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

Building Blocks Skeleton Aromatic heterocycle compounds Pyrrole compounds

Key Words

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1H-Pyrrolo[2,3-b]pyridine-4-carbonitrile

CAS No. 344327-11-3

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