Diathymosulfone
[CAS# 5964-62-5]

Identification

• Classification: Chemical reagent >> Organic reagent >> Sulfone, sulfoxide compound
• Name: Diathymosulfone
• Synonyms: (4E)-2-Isopropyl-4-[[4-[4-[(N'z)-N'-(5-Isopropyl-2-Methyl-4-Oxo-1-Cyclohexa-2,5-Dienylidene)Hydrazino]Phenyl]Sulfonylphenyl]Hydrazono]-5-Methyl-Cyclohexa-2,5-Dien-1-One; (4E)-2-Isopropyl-4-[[4-[4-[(N'z)-N'-(5-Isopropyl-2-Methyl-4-Oxo-1-Cyclohexa-2,5-Dienylidene)Hydrazino]Phenyl]Sulfonylphenyl]Hydrazono]-5-Methyl-1-Cyclohexa-2,5-Dienone; (4E)-2-Isopropyl-4-[[4-[4-[(N'z)-N'-(5-Isopropyl-4-Keto-2-Methyl-1-Cyclohexa-2,5-Dienylidene)Hydrazino]Phenyl]Sulfonylphenyl]Hydrazono]-5-Methyl-Cyclohexa-2,5-Dien-1-One
• Molecular Formula: C₃₂H₃₄N₄O₄S
• Molecular Weight: 570.71
• CAS Registry Number: 5964-62-5
• SMILES: C3=C([S](=O)(=O)C2=CC=C(N\N=C\1C=C(C(C)C)C(=O)C=C1C)C=C2)C=CC(=C3)N\N=C/4C=C(C(C)C)C(=O)C=C4C
• InChI: 1S/C32H34N4O4S/c1-19(2)27-17-29(21(5)15-31(27)37)35-33-23-7-11-25(12-8-23)41(39,40)26-13-9-24(10-14-26)34-36-30-18-28(20(3)4)32(38)16-22(30)6/h7-20,33-34H,1-6H3/b35-29-,36-30+
• InChIKey: WUSZPNSIGBDYCV-CRHVBUSDSA-N

Properties

• Density: 1.237g/cm³ (Cal.)
• Boiling point: 704.707°C at 760 mmHg (Cal.)
• Flash point: 379.993°C (Cal.)