Description

1,2,6-Oxadithiane 2,2,6,6-tetraoxide (CAS No. 4720-58-5) is a high-purity sulfone derivative with the molecular formula C₃H₆O₅S₂. This specialized heterocyclic compound features a unique oxadithiane core structure with two sulfonyl functional groups, making it a valuable intermediate for advanced organic synthesis and pharmaceutical research. Our product is rigorously tested to ensure >98% purity by HPLC, with full characterization data including ¹H NMR, ¹³C NMR, and mass spectrometry available upon request. Supplied as a white crystalline powder with excellent stability under recommended storage conditions (2-8°C in inert atmosphere). Ideal for researchers developing novel sulfone-containing compounds, asymmetric catalysts, or studying structure-activity relationships in medicinal chemistry applications.

Properties

• CAS Number: 4720-58-5
• Complexity: 266
• IUPAC Name: 1,2,6-oxadithiane 2,2,6,6-tetraoxide
• InChI: InChI=1S/C3H6O5S2/c4-9(5)2-1-3-10(6,7)8-9/h1-3H2
• InChI Key: AVPYLKIIPLFMHQ-UHFFFAOYSA-N
• Exact Mass: 185.96566563
• Molecular Formula: C3H6O5S2
• Molecular Weight: 186.2
• SMILES: C1CS(=O)(=O)OS(=O)(=O)C1
• Topological: 94.3
• Monoisotopic Mass: 185.96566563
• Synonyms: 4720-58-5, 1,2,6-Oxadithiane, 2,2,6,6-tetraoxide, SCHEMBL139980, DTXSID90480493, AVPYLKIIPLFMHQ-UHFFFAOYSA-N

Application

This sulfone derivative serves as a versatile building block in organic synthesis, particularly for constructing complex heterocyclic systems. Researchers utilize it in the development of novel pharmaceutical intermediates with potential biological activity. The compound’s unique structure makes it valuable for studying sulfone reactivity patterns in nucleophilic substitution reactions. It has shown utility in materials science for creating specialized polymers with enhanced thermal stability.

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