54549-72-3 | 1-(4-(2-Hydroxypropan-2-yl)phenyl)ethanone

Packsize	Purity	Availability	Price	Discounted Price
100mg	95%	in stock	$162.00	$113.00
250mg	95%	in stock	$232.00	$162.00
1g	95%	in stock	$592.00	$414.00

Description

• Catalog Number: AB47317
• Chemical Name: 1-(4-(2-Hydroxypropan-2-yl)phenyl)ethanone
• CAS Number: 54549-72-3
• Molecular Formula: C11H14O2
• Molecular Weight: 178.2277
• MDL Number: MFCD18971205
• SMILES: CC(=O)c1ccc(cc1)C(O)(C)C

Computed Properties

• Complexity: 188
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 1.4

Upstream Synthesis Route

1-(4-(2-hydroxypropan-2-yl)phenyl) ethanone is a versatile compound that finds wide utility in chemical synthesis applications. This compound serves as a valuable building block for the creation of various organic molecules due to its unique structural features. In particular, the presence of both a phenyl group and a ketone functional group in its chemical makeup allows for a range of synthetic transformations and reactions to take place. When employed in chemical synthesis, 1-(4-(2-hydroxypropan-2-yl)phenyl) ethanone can serve as a key intermediate in the production of pharmaceuticals, agrochemicals, and fine chemicals. Its reactivity and compatibility with a variety of functional groups make it a favorable choice for the construction of complex molecular structures. Additionally, its chiral centers and multiple points of substitution offer opportunities for stereochemical control and diversity-oriented synthesis strategies. Furthermore, the hydroxy and ketone moieties in 1-(4-(2-hydroxypropan-2-yl)phenyl) ethanone enable it to participate in key organic reactions such as nucleophilic addition, condensation, and oxidation processes. These chemical transformations allow for the introduction of new functionalities and the modification of the molecule's properties to suit specific synthetic goals. In essence, the strategic inclusion of 1-(4-(2-hydroxypropan-2-yl)phenyl) ethanone in chemical synthesis endeavors offers chemists a powerful tool for the efficient and versatile construction of diverse organic compounds with potential applications across various industries.