6,7-Dimethoxy-3-[(5R)-4-Methoxy-6-Methyl-7,8-Dihydro-5H-[1,3]Dioxolo[4,5-g]Isoquinolin-5-Yl]-3H-2-Benzofuran-1-One
[CAS# 3860-46-6]

Identification

• Name: 6,7-Dimethoxy-3-[(5R)-4-Methoxy-6-Methyl-7,8-Dihydro-5H-[1,3]Dioxolo[4,5-g]Isoquinolin-5-Yl]-3H-2-Benzofuran-1-One
• Synonyms: 6,7-Dimethoxy-3-[(5R)-4-Methoxy-6-Methyl-7,8-Dihydro-5H-[1,3]Dioxolo[4,5-G]Isoquinolin-5-Yl]-3H-Isobenzofuran-1-One; Idi1_000323; Kbio1_000323
• Molecular Formula: C₂₂H₂₃NO₇
• Molecular Weight: 413.43
• CAS Registry Number: 3860-46-6
• SMILES: [C@@H]3(C1=C(C=C2C(=C1OC)OCO2)CCN3C)C4C5=C(C(O4)=O)C(=C(C=C5)OC)OC
• InChI: 1S/C22H23NO7/c1-23-8-7-11-9-14-20(29-10-28-14)21(27-4)15(11)17(23)18-12-5-6-13(25-2)19(26-3)16(12)22(24)30-18/h5-6,9,17-18H,7-8,10H2,1-4H3/t17-,18?/m1/s1
• InChIKey: AKNNEGZIBPJZJG-QNSVNVJESA-N

Properties

• Density: 1.333g/cm³ (Cal.)
• Boiling point: 565.316°C at 760 mmHg (Cal.)
• Flash point: 295.692°C (Cal.)