2-Amino-5-bromo-3-chlorobenzoic acid

Name: 2-Amino-5-bromo-3-chlorobenzoic acid
Brand: ChemScene
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CAS No. 58026-21-4
Cat. No. CS-0160013
Purity≥95%
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+
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-5-bromo-3-chlorobenzoic acid|CS-0160013

Structure of 58026-21-4

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General Information

CAS No. 58026-21-4
Cat. No. CS-0160013
Purity ≥95%
MDL No. None
Storage RT, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₇H₅BrClNO₂
Molecular Weight 250.48
Synonym(s) 5-Bromo-3-chloroanthranilic acid
SMILES O=C(O)C1=CC(Br)=CC(Cl)=C1N

Description

2-Amino-5-bromo-3-chlorobenzoic acid features a highly functionalized aromatic core with complementary electron-donating and withdrawing substituents. This combination enables efficient coupling in cross-coupling reactions and facilitates integration into bioactive scaffolds requiring precise electronic tuning. The carboxylic acid group supports derivatization, while the amino functionality offers direct access to amide and heterocyclic linkages.

Application

2-Amino-5-bromo-3-chlorobenzoic acid serves as a versatile building block in medicinal chemistry and heterocyclic synthesis, offering orthogonal functional handles for downstream derivatization. The amino group enables nucleophilic substitution or coupling reactions, while the bromo and chloro substituents facilitate palladium-catalyzed cross-couplings. Its bench-stable crystalline form simplifies handling and purification, making it well-suited for modular synthesis of complex scaffolds in API development.

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

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Computational Chemistry Data

TPSA 63.32
LogP 2.3829
H_Acceptors 2
H_Donors 2
Rotatable_Bonds 1

Other Classifications

Building Blocks Functional Group Chloride

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-5-bromo-3-chlorobenzoic acid

CAS No. 58026-21-4

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