1016641-53-4 | 3-Methyl-6-(4,4,5,5-tetramethyl[1,3,2]dioxaborolan-2-yl)-3h-benzooxazol-2-one

Packsize	Purity	Availability	Price	Discounted Price
100mg	97%	in stock	$29.00	$21.00
250mg	97%	in stock	$48.00	$34.00
1g	97%	in stock	$115.00	$81.00
5g	97%	in stock	$469.00	$329.00
10g	97%	in stock	$880.00	$616.00

Description

• Catalog Number: AA06421
• Chemical Name: 3-Methyl-6-(4,4,5,5-tetramethyl[1,3,2]dioxaborolan-2-yl)-3h-benzooxazol-2-one
• CAS Number: 1016641-53-4
• Molecular Formula: C14H18BNO4
• Molecular Weight: 275.108
• MDL Number: MFCD19689521
• SMILES: Cn1c(=O)oc2c1ccc(c2)B1OC(C(O1)(C)C)(C)C

Computed Properties

• Complexity: 409
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 20
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1

Upstream Synthesis Route

The 3-Methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazol-2(3H)-one compound serves as a valuable building block in chemical synthesis due to its unique structural features and reactivity. When used in synthesis, this compound acts as a key intermediate in the formation of various complex organic molecules. Its boron-containing moiety enables selective functionalization reactions, allowing chemists to introduce specific functional groups at desired positions within a molecule. Moreover, the oxazolone ring system offers opportunities for further elaboration through cyclization or annulation reactions, leading to the creation of diverse chemical structures. Overall, the use of 3-Methyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzo[d]oxazol-2(3H)-one in chemical synthesis enables the efficient and controlled construction of intricate organic compounds with tailored properties and functionalities.