Methyl 4,6-dichloronicotinate

Name: Methyl 4,6-dichloronicotinate
Brand: ChemScene
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CAS No. 65973-52-6
Cat. No. CS-W003200
Purity≥97%
MDL No.MFCD04125732

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
Inaccessible (Haz class 6.1 or 9), Domestic	$68.00+
Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
Accessible (Haz class 3, 4, 5 or 8), International	$238.00+

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Methyl 4,6-dichloronicotinate|CS-W003200

Structure of 65973-52-6

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Description

Methyl 4,6-dichloronicotinate is a bench-stable, electron-deficient heterocyclic ester featuring two chlorine substituents at the 4- and 6-positions of the nicotinate ring. This configuration enhances electrophilicity at the carbonyl carbon, enabling efficient coupling reactions in synthetic pathways. The compound serves as a key building block for functionalized pyridine derivatives used in medicinal chemistry and agrochemical development.

Application

Methyl 4,6-dichloronicotinate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to substituted nicotinates and heterocyclic scaffolds. Its dual chloro substituents at the 4- and 6-positions provide enhanced electrophilicity for nucleophilic aromatic substitution, facilitating late-stage functionalization. The methyl ester group offers compatibility with standard coupling and reduction protocols. This compound exhibits bench stability, ease of purification, and broad functional group tolerance, making it well-suited for medicinal chemistry campaigns and process development.

General Information

CAS No. 65973-52-6
Cat. No. CS-W003200
Purity ≥97%
MDL No. MFCD04125732
Storage 4°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₅Cl₂NO₂
Molecular Weight 206.03
Synonym(s) None
SMILES O=C(OC)C1=CN=C(Cl)C=C1Cl

Computational Chemistry Data

TPSA 39.19
LogP 2.175
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 1

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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Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

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Methyl 4,6-dichloronicotinate

CAS No. 65973-52-6

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