methyl 2,4-dibromobenzoate

Name: methyl 2,4-dibromobenzoate
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CAS No. 54335-33-0
Cat. No. CS-0037930
Purity≥98%
MDL No.None

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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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Structure of 54335-33-0

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Description

Methyl 2,4-dibromobenzoate features two bromine substituents at the ortho and para positions relative to the ester group, enabling selective functionalization in cross-coupling reactions. This electron-deficient aromatic scaffold integrates readily into complex molecular architectures under standard conditions.

Application

Methyl 2,4-dibromobenzoate serves as a versatile dihalogenated building block for palladium-catalyzed cross-coupling reactions, enabling efficient construction of substituted biaryl and heteroaryl scaffolds. The methyl ester functionality provides stability and facilitates purification, while the ortho- and para-bromine atoms offer complementary reactivity in sequential coupling processes. This compound functions reliably in standard Suzuki, Stille, and Negishi protocols, supporting scalable synthesis of complex aromatic architectures in medicinal chemistry and materials science applications.

General Information

CAS No. 54335-33-0
Cat. No. CS-0037930
Purity ≥98%
MDL No. None
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₆Br₂O₂
Molecular Weight 293.94
Synonym(s) 2,4-Dibromobenzoic Acid Methyl Ester
SMILES COC(=O)C1=CC=C(C=C1Br)Br

Computational Chemistry Data

TPSA 26.3
LogP 2.9982
H_Acceptors 2
H_Donors 0
Rotatable_Bonds 1

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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Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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methyl 2,4-dibromobenzoate

CAS No. 54335-33-0

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