Methyl 5-amino-2-fluorobenzoate

Name: Methyl 5-amino-2-fluorobenzoate
Brand: ChemScene
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CAS No. 56741-34-5
Cat. No. CS-0035913
Purity≥98%
MDL No.MFCD09037918

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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 5-amino-2-fluorobenzoate|CS-0035913

Structure of 56741-34-5

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Description

Methyl 5-amino-2-fluorobenzoate features a strategically positioned amino group flanking a fluorinated benzene ring, enabling selective functionalization in medicinal chemistry. This electron-rich scaffold integrates readily into complex architectures, offering enhanced solubility and metabolic stability in bioactive compound development.

Application

Methyl 5-amino-2-fluorobenzoate serves as a versatile building block in medicinal chemistry, enabling direct access to fluorinated aromatic scaffolds via standard amine functionalization and ester manipulation. Its ortho-fluoro and para-amino groups exhibit complementary reactivity, facilitating sequential coupling reactions, palladium-catalyzed cross-couplings, and regioselective derivatization. The compound demonstrates excellent bench stability and ease of purification, making it well-suited for scalable synthesis of bioactive heterocycles and API intermediates.

General Information

CAS No. 56741-34-5
Cat. No. CS-0035913
Purity ≥98%
MDL No. MFCD09037918
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₈H₈FNO₂
Molecular Weight 169.15
Synonym(s) 5-amino-2-fluorobenzoic acid methyl ester
SMILES COC(=O)C1=C(C=CC(=C1)N)F

Computational Chemistry Data

TPSA 52.32
LogP 1.1945
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
Precautionary Statements : P264-P270-P330-P501

Quality Control

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Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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Methyl 5-amino-2-fluorobenzoate

CAS No. 56741-34-5

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