Methyl 4-amino-3-bromo-5-chlorobenzoate

Name: Methyl 4-amino-3-bromo-5-chlorobenzoate
Brand: ChemScene
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CAS No. 914636-88-7
Cat. No. CS-0150847
Purity≥96%
MDL No.MFCD08436084

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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-amino-3-bromo-5-chlorobenzoate|CS-0150847

Structure of 914636-88-7

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Description

Methyl 4-amino-3-bromo-5-chlorobenzoate features a benzene ring bearing complementary functional groups: a methyl ester, an amino group, and halogens at adjacent positions. This electron-rich scaffold enables direct coupling in cross-coupling reactions and serves as a key intermediate in pharmaceutical synthesis, particularly for targeted heterocycle construction under standard conditions.

Application

Methyl 4-amino-3-bromo-5-chlorobenzoate serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling efficient access to substituted benzimidazoles, pyrazoles, and other heterocyclic scaffolds. The molecule combines orthogonal functional groups—amine, bromo, chloro, and ester—that facilitate sequential cross-coupling, electrophilic substitution, and amide formation under standard reaction conditions. Its bench stability and compatibility with palladium-catalyzed reactions make it well-suited for modular library construction and process-scale applications.

General Information

CAS No. 914636-88-7
Cat. No. CS-0150847
Purity ≥96%
MDL No. MFCD08436084
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₇BrClNO₂
Molecular Weight 264.50
Synonym(s) None
SMILES COC(=O)C1=CC(=C(C(=C1)Cl)N)Br

Computational Chemistry Data

TPSA 52.32
LogP 2.4713
H_Acceptors 3
H_Donors 1
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-P330-P362+P364-P405-P501

Quality Control

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Other Classifications

Building Blocks Functional Group Chloride

Building Blocks Functional Group Bromide

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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Methyl 4-amino-3-bromo-5-chlorobenzoate

CAS No. 914636-88-7

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