2-Bromo-1-chloro-3-iodobenzene

Name: 2-Bromo-1-chloro-3-iodobenzene
Brand: ChemScene
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CAS No. 1369793-66-7
Cat. No. CS-0098641
Purity≥98%
MDL No.MFCD28397823

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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-Bromo-1-chloro-3-iodobenzene|CS-0098641

Structure of 1369793-66-7

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General Information

CAS No. 1369793-66-7
Cat. No. CS-0098641
Purity ≥98%
MDL No. MFCD28397823
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₃BrClI
Molecular Weight 317.35
Synonym(s) 1-Bromo-2-chloro-6-iodobenzene
SMILES IC1=C(Br)C(Cl)=CC=C1

Description

2-Bromo-1-chloro-3-iodobenzene is a trihalogenated aromatic compound featuring distinct halogen substituents at adjacent positions on the benzene ring. This configuration enables selective cross-coupling reactions in transition-metal-catalyzed processes, where each halogen offers divergent reactivity profiles. The molecule's defined substitution pattern supports precise functionalization in complex synthesis workflows.

Application

2-Bromo-1-chloro-3-iodobenzene serves as a versatile trihalogenated benzene building block for palladium-catalyzed cross-coupling reactions. Its orthogonal halogen reactivity enables sequential functionalization, with the iodine moiety typically reacting first under mild conditions. The molecule exhibits good bench stability and facilitates efficient diversification in medicinal chemistry and materials synthesis 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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

TPSA 0
LogP 3.7071
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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2-Bromo-1-chloro-3-iodobenzene

CAS No. 1369793-66-7

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