539-92-4 | Diisobutyl carbonate

Packsize	Purity	Availability	Price	Discounted Price
250mg	95%	in stock	$750.00	$525.00
500mg	95%	in stock	$1,457.00	$1,020.00
1g	95%	in stock	$1,855.00	$1,298.00

Description

• Catalog Number: AB53676
• Chemical Name: Diisobutyl carbonate
• CAS Number: 539-92-4
• Molecular Formula: C9H18O3
• Molecular Weight: 174.2374
• MDL Number: MFCD00026479
• SMILES: CC(COC(=O)OCC(C)C)C
• NSC Number: 4009

Computed Properties

• Complexity: 116
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• XLogP3: 3.2

Upstream Synthesis Route

Diisobutyl carbonate is a versatile compound commonly used in chemical synthesis processes. Its primary application lies in its role as a solvent and reagent in various organic reactions. Due to its unique chemical properties, diisobutyl carbonate serves as an effective medium for promoting esterification, transesterification, and other important transformations in organic chemistry. This compound is particularly valued for its ability to facilitate the synthesis of specialty chemicals, pharmaceutical intermediates, and polymers. In addition, diisobutyl carbonate can act as a protective group during certain reactions, offering a strategic advantage in the overall synthesis strategy. Its compatibility with a wide range of functional groups further enhances its utility in the preparation of complex molecules with specific structural requirements. Furthermore, diisobutyl carbonate's environmentally friendly nature and low toxicity make it a preferred choice for sustainable chemical synthesis practices.