Methyl 2-fluoro-4-iodonicotinate

Name: Methyl 2-fluoro-4-iodonicotinate
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CAS No. 884494-84-2
Cat. No. CS-W022808
Purity≥95%
MDL No.MFCD04972401

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Methyl 2-fluoro-4-iodonicotinate|CS-W022808

Structure of 884494-84-2

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General Information

CAS No. 884494-84-2
Cat. No. CS-W022808
Purity ≥95%
MDL No. MFCD04972401
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₅FINO₂
Molecular Weight 281.02
Synonym(s) methyl 2-fluoro-4-iodo-pyridine-3-carboxylate
SMILES O=C(OC)C1=C(F)N=CC=C1I

Description

Methyl 2-fluoro-4-iodonicotinate is a fluorinated heterocyclic ester featuring complementary halogen handles for cross-coupling. The para-iodo group enables palladium-catalyzed transformations, while the ortho-fluoro substituent facilitates selective functionalization. This bifunctional scaffold integrates readily into complex molecular architectures under standard conditions.

Application

Methyl 2-fluoro-4-iodonicotinate serves as a versatile building block for C–H functionalization and cross-coupling reactions, enabling efficient access to substituted pyridine scaffolds. The fluorine and iodine substituents provide orthogonal reactivity—fluorine facilitates electrophilic substitution or nucleophilic displacement, while the iodine supports palladium-catalyzed coupling. Its bench-stable nature and compatibility with standard reaction conditions make it well-suited for medicinal chemistry and process development workflows.

Safety Information

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GHS Pictogram : N/A	GHS No : N/A
Signal Word : N/A	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

TPSA 39.19
LogP 1.6119
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

Key Words

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Methyl 2-fluoro-4-iodonicotinate

CAS No. 884494-84-2

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