Methyl 6-chloro-5-methylnicotinate

Name: Methyl 6-chloro-5-methylnicotinate
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CAS No. 65169-42-8
Cat. No. CS-0153169
Molecule weight185.61
Purity≥98%
MDL No.MFCD18258043

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Methyl 6-chloro-5-methylnicotinate|CS-0153169

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General Information

CAS No. 65169-42-8
Cat. No. CS-0153169
Purity ≥98%
MDL No. MFCD18258043
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₈ClNO₂
Molecular Weight 185.61
Synonym(s) Methyl 6-chloro-5-methylpyridine-3-carboxylate
SMILES CC1=CC(=CN=C1Cl)C(=O)OC

Description

Methyl 6-chloro-5-methylnicotinate is a halogenated pyridine derivative featuring a chloro substituent at the 6-position and a methyl group at the 5-position, enabling selective functionalization in heterocyclic synthesis. The ester moiety enhances solubility and facilitates downstream transformations. This compound serves as a key intermediate in medicinal chemistry campaigns targeting kinase inhibitors and bioactive nitrogen heterocycles.

Application

Methyl 6-chloro-5-methylnicotinate serves as a versatile building block in medicinal chemistry, enabling efficient construction of substituted pyridine scaffolds. Its ortho-halogen and methyl substituents facilitate palladium-catalyzed cross-coupling reactions and regioselective functionalization. The ester group provides a handle for further transformations, while the molecule exhibits excellent bench stability and compatibility with standard synthetic workflows.

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 39.19
LogP 1.83002
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

Key Words

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Methyl 6-chloro-5-methylnicotinate

CAS No. 65169-42-8

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