Methyl 2-chloro-3-nitropyridine-4-carboxylate

Name: Methyl 2-chloro-3-nitropyridine-4-carboxylate
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CAS No. 1379302-09-6
Cat. No. CS-0049173
Purity≥98%
MDL No.None

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Methyl 2-chloro-3-nitropyridine-4-carboxylate|CS-0049173

Structure of 1379302-09-6

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Description

Methyl 2-chloro-3-nitropyridine-4-carboxylate features a pyridine core functionalized with chloro, nitro, and ester groups at distinct positions, enabling selective derivatization. This electron-deficient heterocycle serves as a key intermediate in the synthesis of bioactive nitrogen-containing compounds, particularly in medicinal chemistry and agrochemical development. The molecule exhibits robust stability under standard handling conditions and facilitates efficient coupling reactions due to its well-defined reactivity profile.

Application

Methyl 2-chloro-3-nitropyridine-4-carboxylate serves as a versatile heterocyclic building block in medicinal chemistry, enabling efficient functionalization at the C2 and C3 positions. Its chloro group facilitates nucleophilic substitution reactions, while the nitro and ester functionalities offer orthogonal handles for further derivatization. The compound exhibits good bench stability and is compatible with standard coupling protocols, making it well-suited for the synthesis of pyridine-based pharmacophores and API intermediates.

General Information

CAS No. 1379302-09-6
Cat. No. CS-0049173
Purity ≥98%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₅ClN₂O₄
Molecular Weight 216.58
Synonym(s) None
SMILES COC(=O)C1=C(C(Cl)=NC=C1)[N+]([O-])=O

Computational Chemistry Data

TPSA 82.33
LogP 1.4298
H_Acceptors 5
H_Donors 0
Rotatable_Bonds 2

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
Precautionary Statements : P264-P270-P330-P501

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Other Classifications

Building Blocks Functional Group Nitro compounds

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

Key Words

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Methyl 2-chloro-3-nitropyridine-4-carboxylate

CAS No. 1379302-09-6

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