2-Methyl-N1-benzenesulfonyl-N4-bromoacetylquinonediimide
[CAS# 62442-86-8]

Identification

• Name: 2-Methyl-N1-benzenesulfonyl-N4-bromoacetylquinonediimide
• Synonyms: 2-Bromo-N-[(4Z)-3-Methyl-4-Phenylsulfonylimino-1-Cyclohexa-2,5-Dienylidene]Acetamide; 2-Bromo-N-(3-Methyl-4-Phenylsulfonylimino-1-Cyclohexa-2,5-Dienylidene)Acetamide; 2-Bromo-N-[(4E)-3-Methyl-4-Phenylsulfonylimino-1-Cyclohexa-2,5-Dienylidene]Ethanamide
• Molecular Formula: C₁₅H₁₃BrN₂O₃S
• Molecular Weight: 381.24
• CAS Registry Number: 62442-86-8
• SMILES: C2=C([S](N=C1C(=CC(=NC(CBr)=O)C=C1)C)(=O)=O)C=CC=C2
• InChI: 1S/C15H13BrN2O3S/c1-11-9-12(17-15(19)10-16)7-8-14(11)18-22(20,21)13-5-3-2-4-6-13/h2-9H,10H2,1H3
• InChIKey: KBZGGWYMBUCHAU-UHFFFAOYSA-N

Properties

• Density: 1.491g/cm³ (Cal.)
• Boiling point: 482.892°C at 760 mmHg (Cal.)
• Flash point: 245.844°C (Cal.)