(13S,13aR)-3,9,10-Trimethoxy-13-Methyl-5,8,13,13A-Tetrahydro-6H-Isoquinolino[3,2-a]Isoquinolin-2-Ol
[CAS# 22672-74-8]

Identification

• Name: (13S,13aR)-3,9,10-Trimethoxy-13-Methyl-5,8,13,13A-Tetrahydro-6H-Isoquinolino[3,2-a]Isoquinolin-2-Ol
• Molecular Formula: C₂₁H₂₅NO₄
• Molecular Weight: 355.43
• CAS Registry Number: 22672-74-8
• SMILES: C[C@@H]1[C@@H]2C3=CC(=C(C=C3CCN2CC4=C1C=CC(=C4OC)OC)OC)O
• InChI: 1S/C21H25NO4/c1-12-14-5-6-18(24-2)21(26-4)16(14)11-22-8-7-13-9-19(25-3)17(23)10-15(13)20(12)22/h5-6,9-10,12,20,23H,7-8,11H2,1-4H3/t12-,20+/m0/s1
• InChIKey: UABBYTGYXLXVNA-FKIZINRSSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 498.4±45.0°C at 760 mmHg (Cal.)
• Flash point: 255.2±28.7°C (Cal.)
• Refractive index: 1.629 (Cal.)