Methyl 3-amino-2,5-dichlorobenzoate

Name: Methyl 3-amino-2,5-dichlorobenzoate
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CAS No. 7286-84-2
Cat. No. CS-0245736
Purity≥97%
MDL No.None

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Hazmat Ground shipping	$50.00+
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Accessible (Haz class 3, 4, 5 or 8), Domestic	$158.00+
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Methyl 3-amino-2,5-dichlorobenzoate|CS-0245736

Structure of 7286-84-2

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Description

Methyl 3-amino-2,5-dichlorobenzoate features a benzoate core with strategically positioned amino and dichloro substituents, enabling precise functionalization in medicinal chemistry. The electron-rich amine facilitates coupling reactions, while the ortho-chlorines enhance reactivity in cross-coupling processes. This bench-stable derivative integrates readily into complex molecular architectures under standard conditions.

Application

Methyl 3-amino-2,5-dichlorobenzoate serves as a versatile building block in medicinal chemistry, enabling the synthesis of substituted benzimidazoles and other heterocyclic scaffolds. Its amino and ester functionalities offer orthogonal reactivity for amide coupling, electrophilic substitution, and transition-metal-catalyzed cross-coupling reactions. The molecule exhibits good bench stability and facilitates straightforward purification, making it well-suited for iterative synthetic campaigns in API development.

General Information

CAS No. 7286-84-2
Cat. No. CS-0245736
Purity ≥97%
MDL No. None
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₇Cl₂NO₂
Molecular Weight 220.05
Synonym(s) Vegiben 2E
SMILES COC(=O)C1=C(C(=CC(=C1)Cl)N)Cl

Computational Chemistry Data

TPSA 52.32
LogP 2.3622
H_Acceptors 3
H_Donors 1
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-P330-P362+P364-P405-P501

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Other Classifications

Building Blocks Functional Group Chloride

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

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Methyl 3-amino-2,5-dichlorobenzoate

CAS No. 7286-84-2

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