4-Bromo-2-chloro-6-fluoroaniline

Name: 4-Bromo-2-chloro-6-fluoroaniline
Brand: ChemScene
Availability: InStock
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CAS No. 885453-49-6
Cat. No. CS-0093536
Purity≥98%
MDL No.MFCD09878163

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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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4-Bromo-2-chloro-6-fluoroaniline|CS-0093536

Structure of 885453-49-6

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General Information

CAS No. 885453-49-6
Cat. No. CS-0093536
Purity ≥98%
MDL No. MFCD09878163
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₄BrClFN
Molecular Weight 224.46
Synonym(s) 4-Bromo-2-chloro-6-fluoro-phenylamine
SMILES NC1=C(F)C=C(Br)C=C1Cl

Description

4-Bromo-2-chloro-6-fluoroaniline features a trihalogenated aromatic core enabling precise functionalization in pharmaceutical and agrochemical synthesis. The strategically positioned bromo, chloro, and fluoro substituents offer enhanced reactivity and metabolic stability. This electron-deficient aniline derivative facilitates coupling reactions under mild conditions and maintains bench-stability during handling.

Application

4-Bromo-2-chloro-6-fluoroaniline serves as a versatile building block for the synthesis of fluorinated heterocycles and pharmaceutical intermediates. Its ortho-halogenated aniline framework enables palladium-catalyzed cross-coupling reactions with high functional group tolerance. The compound exhibits excellent bench stability, ease of purification, and compatibility with standard amine protection strategies, facilitating efficient access to complex molecular architectures in medicinal chemistry and process development workflows.

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-P302+P352-P304+P340

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Computational Chemistry Data

TPSA 26.02
LogP 2.8238
H_Acceptors 1
H_Donors 1
Rotatable_Bonds 0

Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Chloride

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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4-Bromo-2-chloro-6-fluoroaniline

CAS No. 885453-49-6

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