Methyl 4-bromo-6-chloronicotinate

Name: Methyl 4-bromo-6-chloronicotinate
Brand: ChemScene
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CAS No. 1256790-93-8
Cat. No. CS-0040505
Purity≥98%
MDL No.MFCD18257867

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Type	HazMat Fee
Excepted Quantity	$0.00
FedEx Limited Quantities Ground	$0.00
Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
Inaccessible (Haz class 6.1 or 9), International	$108.00+
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Methyl 4-bromo-6-chloronicotinate|CS-0040505

Structure of 1256790-93-8

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General Information

CAS No. 1256790-93-8
Cat. No. CS-0040505
Purity ≥98%
MDL No. MFCD18257867
Storage -20°C
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₅BrClNO₂
Molecular Weight 250.48
Synonym(s) None
SMILES O=C(C1=C(Br)C=C(Cl)N=C1)OC

Description

Methyl 4-bromo-6-chloronicotinate is a halogenated pyridine derivative featuring strategically positioned bromo and chloro substituents at the 4- and 6-positions of the nicotinate ring. This electron-deficient scaffold enables direct coupling in palladium-catalyzed cross-coupling reactions, offering efficient access to complex heterocyclic architectures in medicinal chemistry and agrochemical synthesis.

Application

Methyl 4-bromo-6-chloronicotinate serves as a versatile building block for the synthesis of biologically active heterocycles and pharmaceutical intermediates. Its ortho-halogenated pyridine core enables efficient Pd-catalyzed cross-coupling reactions, while the methyl ester group offers compatibility with standard functional group manipulations. The compound exhibits excellent bench stability and facilitates straightforward purification, making it well-suited for scalable synthetic 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 39.19
LogP 2.2841
H_Acceptors 3
H_Donors 0
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Bromide

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Pyridine compounds

Key Words

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Methyl 4-bromo-6-chloronicotinate

CAS No. 1256790-93-8

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