(+)-2,3-Dimethoxy-6-[[(5R)-5,6,7,8-Tetrahydro-6-Methyl-1,3-Dioxolo[4,5-g]Isoquinoline-5-Yl]Methyl]Benzaldehyde
[CAS# 52801-27-1]

Identification

• Name: (+)-2,3-Dimethoxy-6-[[(5R)-5,6,7,8-Tetrahydro-6-Methyl-1,3-Dioxolo[4,5-g]Isoquinoline-5-Yl]Methyl]Benzaldehyde
• Synonyms: (.+-.)-Canadaline; Canadalin; Nsc279521
• Molecular Formula: C₂₁H₂₃NO₅
• Molecular Weight: 369.42
• CAS Registry Number: 52801-27-1
• SMILES: C2=C1C(N(C)CCC1=CC3=C2OCO3)CC4=C(C(=C(C=C4)OC)OC)C=O
• InChI: 1S/C21H23NO5/c1-22-7-6-14-9-19-20(27-12-26-19)10-15(14)17(22)8-13-4-5-18(24-2)21(25-3)16(13)11-23/h4-5,9-11,17H,6-8,12H2,1-3H3
• InChIKey: ROAHDZJDHGLGBA-UHFFFAOYSA-N

Properties

• Density: 1.246g/cm³ (Cal.)
• Boiling point: 514.8°C at 760 mmHg (Cal.)
• Flash point: 265.142°C (Cal.)