Methyl 3-amino-2,4-dimethylbenzoate

Name: Methyl 3-amino-2,4-dimethylbenzoate
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CAS No. 24812-89-3
Cat. No. CS-W022820
Purity≥98%
MDL No.MFCD22494937

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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+
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Methyl 3-amino-2,4-dimethylbenzoate|CS-W022820

Structure of 24812-89-3

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Description

Methyl 3-amino-2,4-dimethylbenzoate features a strategically positioned amino group flanked by two methyl substituents on the aromatic ring, enhancing electron density and directing electrophilic substitution. This configuration supports efficient incorporation into complex molecular architectures. The ester functionality enables straightforward derivatization, while the molecule exhibits robust stability under standard bench conditions.

Application

Methyl 3-amino-2,4-dimethylbenzoate serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling straightforward access to substituted benzimidazoles and other heterocyclic scaffolds. The ortho-methyl groups enhance metabolic stability, while the amino and ester functionalities offer complementary handles for derivatization via amidation, acylation, or electrophilic substitution. Bench-stable and readily purified by column chromatography, it functions efficiently in standard coupling and cyclization protocols.

General Information

CAS No. 24812-89-3
Cat. No. CS-W022820
Purity ≥98%
MDL No. MFCD22494937
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₁₃NO₂
Molecular Weight 179.22
Synonym(s) Benzoic acid, 3-aMino-2,4-diMethyl-, Methyl ester
SMILES COC(=O)C1=C(C)C(N)=C(C)C=C1

Computational Chemistry Data

TPSA 52.32
LogP 1.67224
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-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 3-amino-2,4-dimethylbenzoate

CAS No. 24812-89-3

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