2-[4-[(4-Methylphenyl)Sulfonyl]Benzofurazan-7-Yl]Thiopyridine 1-Oxide
[CAS# 58131-53-6]

Identification

• Name: 2-[4-[(4-Methylphenyl)Sulfonyl]Benzofurazan-7-Yl]Thiopyridine 1-Oxide
• Synonyms: 7-(4-Methylphenyl)Sulfonyl-4-[(1-Oxido-2-Pyridin-1-Iumyl)Thio]-2,1,3-Benzoxadiazole; 4-(4-Methylphenyl)Sulfonyl-7-[(1-Oxidopyridin-1-Ium-2-Yl)Thio]Benzofurazan; 4-((4-Methylphenyl)Sulfonyl)-7-(2-Pyridinylthio)Benzofurazan N-Oxide
• Molecular Formula: C₁₈H₁₃N₃O₄S₂
• Molecular Weight: 399.44
• CAS Registry Number: 58131-53-6
• SMILES: C1=CC(=CC=C1C)[S](=O)(=O)C2=CC=C(C3=NON=C23)SC4=CC=CC=[N+]4[O-]
• InChI: 1S/C18H13N3O4S2/c1-12-5-7-13(8-6-12)27(23,24)15-10-9-14(17-18(15)20-25-19-17)26-16-4-2-3-11-21(16)22/h2-11H,1H3
• InChIKey: BCHFBYJCFWYZKB-UHFFFAOYSA-N

Properties

• Density: 1.501g/cm³ (Cal.)
• Boiling point: 703.587°C at 760 mmHg (Cal.)
• Flash point: 379.316°C (Cal.)