Methyl 2-amino-4-chloro-5-methoxybenzoate

Name: Methyl 2-amino-4-chloro-5-methoxybenzoate
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CAS No. 181434-36-6
Cat. No. CS-0102740
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+
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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 2-amino-4-chloro-5-methoxybenzoate|CS-0102740

Structure of 181434-36-6

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General Information

CAS No. 181434-36-6
Cat. No. CS-0102740
Purity ≥98%
MDL No. None
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₉H₁₀ClNO₃
Molecular Weight 215.63
Synonym(s) Benzoic acid, 2-amino-4-chloro-5-methoxy-, methyl ester
SMILES O=C(OC)C1=CC(OC)=C(Cl)C=C1N

Description

Methyl 2-amino-4-chloro-5-methoxybenzoate features a benzene ring bearing amino, chloro, methoxy, and ester functionalities, enabling diverse downstream transformations. This electron-rich scaffold facilitates coupling reactions and serves as a key intermediate in medicinal chemistry, particularly for heterocyclic compound synthesis under standard conditions.

Application

Methyl 2-amino-4-chloro-5-methoxybenzoate serves as a versatile building block in medicinal chemistry, enabling the synthesis of bioactive heterocycles and pharmaceutical intermediates. Its ortho-amino and methoxy groups provide regioselective functionalization sites, while the chloro substituent facilitates palladium-catalyzed cross-coupling reactions. The compound exhibits excellent bench stability and ease of purification, making it well-suited for multi-step syntheses and scale-up applications.

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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Computational Chemistry Data

TPSA 61.55
LogP 1.7174
H_Acceptors 4
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Chloride

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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Methyl 2-amino-4-chloro-5-methoxybenzoate

CAS No. 181434-36-6

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