Cupreine
[CAS# 524-63-0]

Identification

• Name: Cupreine
• Synonyms: 4-[Hydroxy-(5-Vinylquinuclidin-1-Ium-2-Yl)Methyl]Quinolin-6-Ol Chloride; 4-[Hydroxy-(5-Vinyl-2-Quinuclidin-1-Iumyl)Methyl]-6-Quinolinol Chloride; 4-[(5-Ethenyl-1-Azoniabicyclo[2.2.2]Octan-7-Yl)-Hydroxy-Methyl]Quinolin-6-Ol Chloride
• Molecular Formula: C₁₉H₂₃ClN₂O₂
• Molecular Weight: 346.86
• CAS Registry Number: 524-63-0
• EINECS: 208-363-9
• SMILES: C1=CN=C4C(=C1C(O)C2[NH+]3CC(C(C2)CC3)C=C)C=C(O)C=C4.[Cl-]
• InChI: 1S/C19H22N2O2.ClH/c1-2-12-11-21-8-6-13(12)9-18(21)19(23)15-5-7-20-17-4-3-14(22)10-16(15)17;/h2-5,7,10,12-13,18-19,22-23H,1,6,8-9,11H2;1H
• InChIKey: PSXDRNCJTBOUPR-UHFFFAOYSA-N

Properties

• Boiling point: 514.6°C at 760 mmHg (Cal.)
• Flash point: 265°C (Cal.)