1-Acetylazepanium methyl sulfate
[CAS# 85851-62-3]

Identification

• Name: 1-Acetylazepanium methyl sulfate
• Synonyms: 1-acetylhexahydro-1H-azepinium methyl sulphate
• Molecular Formula: C₉H₁₉NO₅S
• Molecular Weight: 253.32
• CAS Registry Number: 85851-62-3
• EINECS: 288-623-6
• SMILES: O=C([NH+]1CCCCCC1)C.[O-]S(=O)(=O)OC
• InChI: 1S/C8H15NO.CH4O4S/c1-8(10)9-6-4-2-3-5-7-9;1-5-6(2,3)4/h2-7H2,1H3;1H3,(H,2,3,4)
• InChIKey: JLKCDRWIHBETHZ-UHFFFAOYSA-N

Properties

• Boiling point: 438.9°C at 760 mmHg (Cal.)
• Flash point: 219.2°C (Cal.)