Methyl 4-acetylpicolinate

Name: Methyl 4-acetylpicolinate
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CAS No. 934016-09-8
Cat. No. CS-0095190
Molecule weight179.17
Purity≥96%
MDL No.None

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General Information

CAS No. 934016-09-8
Cat. No. CS-0095190
Purity ≥96%
MDL No. None
Storage RT, stored under nitrogen
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₉NO₃
Molecular Weight 179.17
Synonym(s) methyl 4-acetylpyridine-2-carboxylate
SMILES O=C(C1=NC=CC(C(C)=O)=C1)OC

Description

Methyl 4-acetylpicolinate features a pyridine core bearing an acetyl group at the 4-position and a methyl ester at the 3-position, delivering enhanced solubility and stability under standard conditions. This configuration enables direct incorporation into synthetic sequences requiring electron-deficient heterocyclic scaffolds.

Application

Methyl 4-acetylpicolinate serves as a versatile building block in synthetic organic chemistry, enabling access to pyridine-based heterocycles and bioactive scaffolds. The acetyl group provides a handle for selective transformations, while the methyl ester facilitates downstream functionalization. Its bench-stable nature and compatibility with common reaction conditions make it well-suited for iterative synthesis workflows in medicinal chemistry and process development.

Safety Information

Download SDS

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 56.26
LogP 1.0708
H_Acceptors 4
H_Donors 0
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

Key Words

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Methyl 4-acetylpicolinate

CAS No. 934016-09-8

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