10558-25-5 | 4-Bromo-3,5-dimethylisoxazole

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$6.00	$4.00
5g	98%	in stock	$7.00	$5.00
10g	98%	in stock	$9.00	$6.00
25g	98%	in stock	$20.00	$14.00
100g	98%	in stock	$68.00	$48.00

Description

• Catalog Number: AB66906
• Chemical Name: 4-Bromo-3,5-dimethylisoxazole
• CAS Number: 10558-25-5
• Molecular Formula: C5H6BrNO
• Molecular Weight: 176.0112
• MDL Number: MFCD00068187
• SMILES: Brc1c(C)noc1C
• NSC Number: 254973

Computed Properties

• Complexity: 88.5
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 8
• Hydrogen Bond Acceptor Count: 2
• XLogP3: 1.9

Upstream Synthesis Route

4-Bromo-3,5-dimethylisoxazole serves as a valuable building block in chemical synthesis due to its versatile reactivity and structural properties. This compound is commonly used in the pharmaceutical and agrochemical industries as a key intermediate for the synthesis of various biologically active compounds. Its unique five-membered heterocyclic structure containing both bromine and methyl groups allows for diverse functionalization pathways, making it an important precursor in organic synthesis. In particular, 4-Bromo-3,5-dimethylisoxazole is often utilized in the construction of complex molecules through Suzuki coupling reactions, Heck reactions, and metal-catalyzed cross-coupling reactions. Additionally, its presence in drug discovery research highlights its significance in the development of new therapeutic agents with potential applications in medicinal chemistry and chemical biology. Overall, the strategic incorporation of 4-Bromo-3,5-dimethylisoxazole in synthetic routes enables the efficient and targeted synthesis of novel compounds with tailored properties for various scientific applications.