2113-57-7 | 3-Bromobiphenyl

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$10.00	$7.00
5g	98%	in stock	$13.00	$9.00
10g	≥98%	in stock	$15.00	$10.00
25g	≥98%	in stock	$22.00	$15.00
500g	98%	in stock	$401.00	$281.00

Description

• Catalog Number: AB20686
• Chemical Name: 3-Bromobiphenyl
• CAS Number: 2113-57-7
• Molecular Formula: C12H9Br
• Molecular Weight: 233.1039
• MDL Number: MFCD00000082
• SMILES: Brc1cccc(c1)c1ccccc1
• NSC Number: 407775

Computed Properties

• Complexity: 149
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Rotatable Bond Count: 1
• XLogP3: 4.6

Upstream Synthesis Route

3-Bromo-1,1'-biphenyl is a versatile compound that finds wide application in chemical synthesis due to its unique reactivity and structural features. In organic synthesis, 3-Bromo-1,1'-biphenyl serves as a key building block in the preparation of various pharmaceuticals, agrochemicals, and functional materials. Its bromine atom can undergo various substitution reactions, leading to the introduction of different functional groups onto the biphenyl backbone.One of the key applications of 3-Bromo-1,1'-biphenyl is in cross-coupling reactions, where it acts as a valuable aryl halide substrate. This compound can participate in Suzuki-Miyaura reactions, Heck reactions, and other palladium-catalyzed coupling reactions to form biaryl compounds. These biaryl products have widespread utility in medicinal chemistry, materials science, and other fields.Additionally, 3-Bromo-1,1'-biphenyl can be used in the synthesis of liquid crystals and organic semiconductors. By functionalizing the biphenyl core with suitable substituents, researchers can tailor the electronic and optical properties of the resulting materials. This compound's rigid and planar structure is advantageous for promoting π-π interactions in the solid state, making it a valuable component in the design of advanced organic materials with specific functionalities.Overall, the versatility of 3-Bromo-1,1'-biphenyl in chemical synthesis makes it a valuable tool for accessing a diverse array of biaryl compounds and functional materials with tailored properties.