1009303-59-6 | 3-Cyano-4-isopropoxyphenylboronic acid

Packsize	Purity	Availability	Price	Discounted Price
100mg	98%	in stock	$83.00	$59.00
250mg	98%	in stock	$89.00	$62.00
1g	98%	in stock	$201.00	$141.00
5g	98%	in stock	$688.00	$482.00
10g	98%	in stock	$1,162.00	$814.00
25g	98%	in stock	$2,266.00	$1,586.00

Description

• Catalog Number: AA03974
• Chemical Name: 3-Cyano-4-isopropoxyphenylboronic acid
• CAS Number: 1009303-59-6
• Molecular Formula: C10H12BNO3
• Molecular Weight: 205.01818000000003
• MDL Number: MFCD17011847
• SMILES: N#Cc1cc(ccc1OC(C)C)B(O)O

Computed Properties

• Complexity: 248
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 3

Upstream Synthesis Route

(3-Cyano-4-isopropoxyphenyl)boronic acid is a versatile building block in chemical synthesis due to its unique reactivity and functional groups. This compound is commonly used in the synthesis of pharmaceuticals, agrochemicals, and materials science. In organic chemistry, it serves as a valuable reagent for forming carbon-carbon and carbon-heteroatom bonds through Suzuki cross-coupling reactions. Additionally, the cyano group present in the molecule can undergo further transformations to introduce additional functional groups, expanding the structural diversity of the final products. The isopropoxy moiety provides steric hindrance, influencing the regioselectivity and stereochemistry of the reactions. Overall, (3-Cyano-4-isopropoxyphenyl)boronic acid is a key intermediate in the synthesis of complex organic molecules with diverse applications in drug discovery, materials fabrication, and chemical research.