1150271-42-3 | 7-(Methoxycarbonyl)indole-2-boronic acid, pinacol ester

Packsize	Purity	Availability	Price	Discounted Price
250mg	96%	in stock	$139.00	$97.00
1g	96%	in stock	$291.00	$204.00
5g	96%	in stock	$968.00	$678.00
25g	96%	in stock	$3,240.00	$2,268.00

Description

• Catalog Number: AA20178
• Chemical Name: 7-(Methoxycarbonyl)indole-2-boronic acid, pinacol ester
• CAS Number: 1150271-42-3
• Molecular Formula: C16H20BNO4
• Molecular Weight: 301.1453
• MDL Number: MFCD11504970
• SMILES: COC(=O)c1cccc2c1[nH]c(c2)B1OC(C(O1)(C)C)(C)C

Computed Properties

• Complexity: 437
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 22
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3

Upstream Synthesis Route

The compound Methyl 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-7-carboxylate is a versatile building block in chemical synthesis, particularly in the field of organic chemistry. It serves as a valuable precursor for the synthesis of various indole-containing compounds with potential applications in pharmaceuticals, agrochemicals, and materials science. The boronate ester functionality in the molecule enables it to participate in cross-coupling reactions, such as Suzuki-Miyaura coupling, to introduce indole moieties into more complex molecular frameworks. Additionally, the presence of the ester group provides a handle for further derivatization, allowing for the introduction of different functional groups to tailor the properties of the final compound. Overall, Methyl 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-7-carboxylate plays a crucial role in the strategic design and synthesis of novel molecules with diverse applications.