6'-Methoxycinchonan-9-One
[CAS# 569329-55-1]

Identification

• Name: 6'-Methoxycinchonan-9-One
• Synonyms: (6-Methoxy-quinolin-4-yl)-(5-vinyl-1-aza-bicyclo[2.2.2]oct-2-yl)-methanone (quininone); (8α)-6'-Methoxycinchonan-9-one
• Molecular Formula: C₂₀H₂₂N₂O₂
• Molecular Weight: 322.40
• CAS Registry Number: 569329-55-1
• SMILES: COC1=CC2=C(C=CN=C2C=C1)C(=O)C3CC4CCN3CC4C=C
• InChI: 1S/C20H22N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19H,1,7,9-10,12H2,2H3
• InChIKey: SRFCUPVBYYAMIL-UHFFFAOYSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 477.8±45.0°C at 760 mmHg (Cal.)
• Flash point: 242.8±28.7°C (Cal.)
• Refractive index: 1.63 (Cal.)