774608-49-0 | 4-bromo-1-chloro-2-iodobenzene

Packsize	Purity	Availability	Price	Discounted Price
5g	98%	in stock	$14.00	$10.00
10g	98%	in stock	$17.00	$12.00
25g	98%	in stock	$36.00	$26.00
100g	98%	in stock	$143.00	$101.00

Description

• Catalog Number: AB47421
• Chemical Name: 4-bromo-1-chloro-2-iodobenzene
• CAS Number: 774608-49-0
• Molecular Formula: C6H3BrClI
• Molecular Weight: 317.3495
• MDL Number: MFCD07780669
• SMILES: Brc1ccc(c(c1)I)Cl

Computed Properties

• Complexity: 99.1
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 9
• XLogP3: 4.2

Upstream Synthesis Route

4-Bromo-1-chloro-2-iodobenzene, also known as BCIB, is a versatile and valuable compound in chemical synthesis. This compound serves as a key building block in various organic reactions, offering a unique combination of different halogen substituents that can be strategically manipulated for specific synthetic purposes. BCIB is commonly used in the synthesis of complex organic molecules, pharmaceutical intermediates, and materials with fine-tuned properties.One of the primary applications of 4-Bromo-1-chloro-2-iodobenzene is in cross-coupling reactions, particularly in Suzuki-Miyaura and Buchwald-Hartwig reactions. These reactions enable the formation of carbon-carbon and carbon-nitrogen bonds, respectively, by coupling BCIB with suitable partners under mild reaction conditions. The presence of multiple halogen atoms in BCIB offers synthetic chemists the flexibility to control the regioselectivity and stereochemistry of the coupling reactions, leading to the selective formation of desired products.Furthermore, 4-Bromo-1-chloro-2-iodobenzene can be utilized as a halogenation reagent in aromatic substitution reactions. By taking advantage of the different reactivity of the three halogen atoms in BCIB, chemists can functionalize aromatic rings with high regioselectivity, allowing for the introduction of diverse chemical functionalities into organic molecules.In addition to its role in carbon-carbon and carbon-heteroatom bond-forming reactions, BCIB can also participate in diverse transformations such as nucleophilic substitution, radical reactions, and transition metal-catalyzed transformations. The versatile nature of 4-Bromo-1-chloro-2-iodobenzene makes it a valuable tool for synthetic chemists seeking to construct complex molecular architectures with precision and efficiency.