4-Bromo-6-methoxypicolinonitrile

Name: 4-Bromo-6-methoxypicolinonitrile
Brand: ChemScene
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CAS No. 1807164-93-7
Cat. No. CS-0527298
Purity≥97%
MDL No.None

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4-Bromo-6-methoxypicolinonitrile|CS-0527298

Structure of 1807164-93-7

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General Information

CAS No. 1807164-93-7
Cat. No. CS-0527298
Purity ≥97%
MDL No. None
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₅BrN₂O
Molecular Weight 213.03
Synonym(s) 4-Bromo-6-methoxy-2-pyridinecarbonitrile
SMILES N#CC1=NC(OC)=CC(Br)=C1

Description

4-Bromo-6-methoxypicolinonitrile features a pyridine core functionalized with bromine, methoxy, and nitrile groups at the 4-, 6-, and 2-positions, respectively. This electron-deficient scaffold enables direct coupling in cross-coupling reactions and serves as a key building block for heterocyclic synthesis. The methoxy group enhances solubility and modulates electronic properties, while the nitrile provides a handle for further derivatization.

Application

4-Bromo-6-methoxypicolinonitrile serves as a versatile building block in heterocyclic synthesis, enabling palladium-catalyzed cross-coupling reactions due to its well-established reactivity at the bromo and nitrile sites. The methoxy group enhances solubility and modulates electronic properties, while the pyridine core provides a stable scaffold for further functionalization. Its bench-stable nature and compatibility with standard reaction conditions make it ideal for medicinal chemistry and process development workflows.

Safety Information

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GHS Pictogram :	GHS No : GHS06
Signal Word : Danger	UN#: 3439
Class : 6.1	Packing Group : Ⅲ
Hazard Statements : H301-H311-H331
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P405-P501

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Computational Chemistry Data

TPSA 45.91
LogP 1.72438
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

Key Words

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4-Bromo-6-methoxypicolinonitrile

CAS No. 1807164-93-7

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