5-Bromo-1,2-dichloro-3-fluorobenzene

Name: 5-Bromo-1,2-dichloro-3-fluorobenzene
Brand: ChemScene
Availability: InStock
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CAS No. 1000572-93-9
Cat. No. CS-0060177
Purity≥98%
MDL No.MFCD09878164

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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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5-Bromo-1,2-dichloro-3-fluorobenzene|CS-0060177

Structure of 1000572-93-9

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General Information

CAS No. 1000572-93-9
Cat. No. CS-0060177
Purity ≥98%
MDL No. MFCD09878164
Storage Store at room temperature
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₂BrCl₂F
Molecular Weight 243.89
Synonym(s) 3,4-Dichloro-5-fluorobromobenzene
SMILES C1=C(C=C(C(=C1Cl)Cl)F)Br

Description

5-Bromo-1,2-dichloro-3-fluorobenzene features a densely halogenated aromatic core with strategic substitution at the 1,2,3,5-positions. This electron-deficient scaffold enables direct incorporation into cross-coupling reactions and serves as a robust building block for functionalized heterocycles in medicinal chemistry and materials synthesis.

Application

5-Bromo-1,2-dichloro-3-fluorobenzene serves as a versatile building block in medicinal chemistry and materials science, enabling palladium-catalyzed cross-coupling reactions due to its orthogonal halogen reactivity profile. The strategic placement of bromo, chloro, and fluoro substituents allows for sequential functionalization with high chemoselectivity. Its bench-stable nature and compatibility with standard reaction conditions facilitate efficient synthesis of complex aromatic scaffolds and heterocycles used 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

Quality Control

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Computational Chemistry Data

TPSA 0
LogP 3.895
H_Acceptors 0
H_Donors 0
Rotatable_Bonds 0

Other Classifications

Building Blocks Functional Group Chloride

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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5-Bromo-1,2-dichloro-3-fluorobenzene

CAS No. 1000572-93-9

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