1191063-90-7 | 2-Carboxyethylboronic acid, pinacol ester

Packsize	Purity	Availability	Price	Discounted Price
250mg	98%	in stock	$106.00	$75.00
1g	98%	in stock	$235.00	$165.00
5g	98%	in stock	$713.00	$499.00
25g	98%	in stock	$2,112.00	$1,479.00
100g	98%	in stock	$5,920.00	$4,144.00

Description

• Catalog Number: AA23408
• Chemical Name: 2-Carboxyethylboronic acid, pinacol ester
• CAS Number: 1191063-90-7
• Molecular Formula: C9H17BO4
• Molecular Weight: 200.0399
• MDL Number: MFCD12962654
• SMILES: OC(=O)CCB1OC(C(O1)(C)C)(C)C

Computed Properties

• Complexity: 221
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3

Upstream Synthesis Route

The compound 3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)propanoic acid, also known as $name$, is a versatile reagent widely used in chemical synthesis. Its unique structure containing a boron atom makes it particularly valuable in organic chemistry reactions.One common application of $name$ is as a boronic acid derivative in Suzuki-Miyaura cross-coupling reactions. In this reaction, $name$ can be coupled with various aryl or vinyl halides under palladium catalysis to form biaryl or bivinyl compounds. This process is crucial in the synthesis of pharmaceuticals, agrochemicals, and materials science.Another important use of $name$ is its role as a boron source in the preparation of boronic esters or boronate complexes. These compounds are key intermediates in the construction of complex organic molecules, such as natural products and advanced materials.Moreover, $name$ can serve as a ligand in coordination chemistry due to its boron-containing ring structure. In coordination complexes, $name$ can exhibit unique reactivity patterns and selectivity, enabling the formation of novel organometallic compounds with diverse applications.Overall, the versatility of 3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)propanoic acid makes it a valuable tool in chemical synthesis, providing access to a wide range of functionalized molecules and enabling the development of new synthetic methodologies.