2-Amino-4-bromo-5-fluorobenzoic acid

Name: 2-Amino-4-bromo-5-fluorobenzoic acid
Brand: ChemScene
Availability: InStock
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CAS No. 1374208-42-0
Cat. No. CS-0036807
Purity≥98%
MDL No.MFCD08702774

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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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2-Amino-4-bromo-5-fluorobenzoic acid|CS-0036807

Structure of 1374208-42-0

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Description

2-Amino-4-bromo-5-fluorobenzoic acid features a unique trifunctional aromatic core combining amino, bromo, and fluoro substituents with a carboxylic acid group. This configuration enables direct incorporation into diverse synthetic scaffolds, particularly in pharmaceutical intermediates and functional materials where halogen-directed coupling reactions are advantageous. The molecule exhibits enhanced solubility in polar solvents and stability under standard bench conditions.

Application

2-Amino-4-bromo-5-fluorobenzoic acid serves as a versatile building block in medicinal chemistry and agrochemical synthesis, enabling the construction of substituted heterocycles via standard coupling and cyclization protocols. Its ortho-functionalized aromatic core provides excellent regiocontrol in cross-coupling reactions, while the carboxylic acid and amino groups offer complementary handles for derivatization. Bench-stable and readily purified by recrystallization, it facilitates scalable access to complex scaffolds under standard synthetic conditions.

General Information

CAS No. 1374208-42-0
Cat. No. CS-0036807
Purity ≥98%
MDL No. MFCD08702774
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₅BrFNO₂
Molecular Weight 234.02
Synonym(s) None
SMILES C1=C(C(=CC(=C1F)Br)N)C(=O)O

Computational Chemistry Data

TPSA 63.32
LogP 1.8686
H_Acceptors 2
H_Donors 2
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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Carboxylic Acid

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-Amino-4-bromo-5-fluorobenzoic acid

CAS No. 1374208-42-0

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