(R)-6,7-Dimethoxy-3Β-[[(5R,6R)-5,6,7,8-Tetrahydro-6-Methyl-1,3-Dioxolo[4,5-g]Isoquinolin]-5-Yl]Isobenzofuran-1(3H)-One
[CAS# 4370-85-8]

Identification

• Name: (R)-6,7-Dimethoxy-3Β-[[(5R,6R)-5,6,7,8-Tetrahydro-6-Methyl-1,3-Dioxolo[4,5-g]Isoquinolin]-5-Yl]Isobenzofuran-1(3H)-One
• Synonyms: (3R)-6,7-Dimethoxy-3-[(5R)-6-Methyl-7,8-Dihydro-5H-[1,3]Dioxolo[4,5-G]Isoquinolin-5-Yl]-3H-Isobenzofuran-1-One; Spectrum1501009; Cas-5936-28-7
• Molecular Formula: C₂₁H₂₁NO₆
• Molecular Weight: 383.40
• CAS Registry Number: 4370-85-8
• SMILES: [C@@H]1(C2=C(C(O1)=O)C(=C(C=C2)OC)OC)[C@H]4C3=CC5=C(C=C3CCN4C)OCO5
• InChI: 1S/C21H21NO6/c1-22-7-6-11-8-15-16(27-10-26-15)9-13(11)18(22)19-12-4-5-14(24-2)20(25-3)17(12)21(23)28-19/h4-5,8-9,18-19H,6-7,10H2,1-3H3/t18-,19-/m1/s1
• InChIKey: JZUTXVTYJDCMDU-RTBURBONSA-N

Properties

• Density: 1.34g/cm³ (Cal.)
• Boiling point: 548.798°C at 760 mmHg (Cal.)
• Flash point: 285.703°C (Cal.)