25487-66-5 | 3-Carboxyphenylboronic acid

Packsize	Purity	Availability	Price	Discounted Price
5g	98%	in stock	$6.00	$4.00
10g	98%	in stock	$9.00	$6.00
25g	98%	in stock	$19.00	$14.00
100g	98%	in stock	$56.00	$39.00
500g	98%	in stock	$276.00	$193.00

Description

• Catalog Number: AB64606
• Chemical Name: 3-Carboxyphenylboronic acid
• CAS Number: 25487-66-5
• Molecular Formula: C7H7BO4
• Molecular Weight: 165.9391
• MDL Number: MFCD00036833
• SMILES: OB(c1cccc(c1)C(=O)O)O

Computed Properties

• Complexity: 171
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 3
• Rotatable Bond Count: 2

Upstream Synthesis Route

3-Boronobenzoic acid is a versatile compound commonly used in chemical synthesis as a key building block in various reactions. With its unique boronic acid functionality, this compound serves as a valuable tool in organic chemistry applications, particularly in the field of transition metal-catalyzed cross-coupling reactions. By employing 3-Boronobenzoic acid as a starting material, chemists can access a wide array of functionalized aromatic compounds through Suzuki-Miyaura, Heck, and other types of cross-coupling reactions. Additionally, the boronic acid moiety of this compound enables easy functionalization and subsequent derivatization, making it a valuable component in the synthesis of pharmaceuticals, agrochemicals, and other fine chemicals. In summary, 3-Boronobenzoic acid is an essential reagent for various advanced synthetic methodologies in organic chemistry.

Literature

• Expanding the diversity of allosteric bcr-abl inhibitors.

  Journal of medicinal chemistry 20101014

• Inhibitors of bacterial N-succinyl-L,L-diaminopimelic acid desuccinylase (DapE) and demonstration of in vitro antimicrobial activity.

  Bioorganic & medicinal chemistry letters 20091115

• Synthesis and evaluation of 3-(dihydroxyboryl)benzoic acids as D,D-carboxypeptidase R39 inhibitors.

  Journal of medicinal chemistry 20091008