1121586-26-2 | 1-Bromo-2-iodo-4-(trifluoromethoxy)benzene

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$97.00	$68.00
5g	98%	in stock	$350.00	$245.00
10g	98%	in stock	$580.00	$406.00
25g	98%	in stock	$1,146.00	$803.00

Description

• Catalog Number: AD65842
• Chemical Name: 1-Bromo-2-iodo-4-(trifluoromethoxy)benzene
• CAS Number: 1121586-26-2
• Molecular Formula: C7H3BrF3IO
• Molecular Weight: 366.9018
• MDL Number: MFCD12025452
• SMILES: Brc1ccc(cc1I)OC(F)(F)F

Computed Properties

• Complexity: 176
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• XLogP3: 4.4

Upstream Synthesis Route

1-Bromo-2-iodo-4-(trifluoromethoxy)benzene, commonly known as $name$, is a versatile compound widely utilized in chemical synthesis due to its unique properties. This compound serves as a valuable building block in the creation of various organic molecules and pharmaceutical compounds. Its strategic combination of bromine, iodine, and trifluoromethoxy functional groups imparts distinctive reactivity, making it a valuable reagent in the construction of complex molecular structures. $name$ is commonly employed in transition-metal catalyzed cross-coupling reactions, such as Suzuki-Miyaura and Heck reactions, facilitating the formation of carbon-carbon and carbon-heteroatom bonds. This compound's trifluoromethoxy group can serve as a directing group in C-H activation processes, enabling selective functionalization at specific positions on aromatic rings. Moreover, the presence of bromine and iodine atoms in $name$ enhances its utility in radical reactions, where halogen atoms can act as radical acceptors or donors, leading to diverse synthetic pathways.Its application extends to the synthesis of agrochemicals, pharmaceutical intermediates, and materials science. $name$'s ability to introduce both electron-withdrawing and electron-donating groups into target molecules allows for fine-tuning of physicochemical properties, such as solubility, lipophilicity, and pharmacological activity. Overall, 1-Bromo-2-iodo-4-(trifluoromethoxy)benzene plays a crucial role in modern organic synthesis, enabling chemists to access novel chemical structures and advance the frontiers of molecular design.