114322-14-4 | 2,1,3-Benzoxadiazole-4-sulfonyl chloride

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$74.00	$52.00
5g	98%	in stock	$267.00	$187.00
25g	98%	in stock	$1,008.00	$706.00

Description

• Catalog Number: AA14148
• Chemical Name: 2,1,3-Benzoxadiazole-4-sulfonyl chloride
• CAS Number: 114322-14-4
• Molecular Formula: C6H3ClN2O3S
• Molecular Weight: 218.6176
• MDL Number: MFCD00068072
• SMILES: ClS(=O)(=O)c1cccc2c1non2

Computed Properties

• Complexity: 289
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• XLogP3: 1.2

Upstream Synthesis Route

2,1,3-Benzoxadiazole-4-sulfonyl chloride is a versatile compound widely used in chemical synthesis for its unique reactivity and functional group compatibility. This compound serves as a valuable building block in the synthesis of various pharmaceuticals, agrochemicals, and materials due to its ability to easily introduce the benzoxadiazole core into target molecules. In organic chemistry, 2,1,3-Benzoxadiazole-4-sulfonyl chloride is a key reagent for the preparation of complex heterocyclic compounds through cyclization reactions. Its sulfonyl chloride functionality allows for selective derivatization of aromatic systems, enabling the formation of diverse chemical structures with specific properties. Furthermore, this compound can be employed in cross-coupling reactions to facilitate the formation of carbon-carbon and carbon-heteroatom bonds, expanding its utility in the synthesis of biologically active compounds and functional materials. By incorporating 2,1,3-Benzoxadiazole-4-sulfonyl chloride into synthetic routes, chemists can access a wide array of novel compounds with potential applications in drug discovery, material science, and other fields of chemical research.