1045795-70-7 | methyl 4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzoate

Packsize	Purity	Availability	Price	Discounted Price
100mg	97%	in stock	$8.00	$6.00
250mg	97%	in stock	$15.00	$11.00
25g	97%	in stock	$1,216.00	$852.00

Description

• Catalog Number: AE27052
• Chemical Name: methyl 4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzoate
• CAS Number: 1045795-70-7
• Molecular Formula: C15H18BF3O4
• Molecular Weight: 330.1072
• MDL Number: MFCD19105387
• SMILES: COC(=O)c1ccc(cc1C(F)(F)F)B1OC(C(O1)(C)C)(C)C

Computed Properties

• Complexity: 448
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 23
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3

Upstream Synthesis Route

Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2-(trifluoromethyl)benzoate is a versatile compound widely utilized in chemical synthesis for its unique structural and reactive properties. This compound serves as a valuable building block in organic chemistry due to its ability to undergo various transformations leading to the synthesis of complex organic molecules. In particular, it is commonly employed as a key intermediate in the preparation of pharmaceuticals, agrochemicals, and functional materials. Its trifluoromethyl and boron-containing moieties make it a valuable reagent for introducing these important functional groups into target molecules with high efficiency and selectivity. Additionally, the presence of the dioxaborolane group enhances the compound's stability and compatibility in a wide range of reaction conditions, thus making it a popular choice in modern chemical synthesis strategies.