2-Bromo-1-fluoro-4-iodobenzene

Name: 2-Bromo-1-fluoro-4-iodobenzene
Brand: ChemScene
Availability: InStock
Rating: 5 (1 reviews)

CAS No. 811842-30-5
Cat. No. CS-W003193
Purity≥98%
MDL No.MFCD04116322

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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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*For research and further manufacturing use only, not for direct human use.

2-Bromo-1-fluoro-4-iodobenzene|CS-W003193

Structure of 811842-30-5

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Description

2-Bromo-1-fluoro-4-iodobenzene features a trihalogenated aromatic core with distinct electronic and steric profiles. This ortho-fluoro, para-iodo substitution pattern enables selective cross-coupling reactions in palladium-catalyzed transformations. The molecule combines halogen reactivity with enhanced stability under standard conditions, facilitating efficient incorporation into complex molecular architectures.

Application

2-Bromo-1-fluoro-4-iodobenzene serves as a versatile trihalogenated benzene building block for palladium-catalyzed cross-coupling reactions. Its orthogonal halogen reactivity enables sequential functionalization, facilitating the construction of complex biaryl and heteroaryl scaffolds. The molecule exhibits excellent bench stability and compatibility with standard reaction conditions, simplifying purification and scale-up in medicinal chemistry and materials synthesis workflows.

General Information

CAS No. 811842-30-5
Cat. No. CS-W003193
Purity ≥98%
MDL No. MFCD04116322
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₆H₃BrFI
Molecular Weight 300.90
Synonym(s) Benzene, 2-bromo-1-fluoro-4-iodo-
SMILES Ic1ccc(c(c1)Br)F

Computational Chemistry Data

TPSA 0
LogP 3.1928
H_Acceptors 0
H_Donors 0
Rotatable_Bonds 0

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H227-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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Other Classifications

Building Blocks Functional Group Fluoride

Building Blocks Functional Group Bromide

Building Blocks Skeleton Aromatic ring compounds Benzene compounds

Key Words

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2-Bromo-1-fluoro-4-iodobenzene

CAS No. 811842-30-5

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