Tritoqualine
[CAS# 14504-73-5]

Identification

• Name: Tritoqualine
• Synonyms: 7-Amino-4,5,6-Triethoxy-3-(4-Methoxy-6-Methyl-7,8-Dihydro-5H-[1,3]Dioxolo[4,5-G]Isoquinolin-5-Yl)-3H-Isobenzofuran-1-One; Hypostamin; Hypostamine
• Molecular Formula: C₂₆H₃₂N₂O₈
• Molecular Weight: 500.55
• CAS Registry Number: 14504-73-5
• SMILES: C1=C5C(=C(C2=C1CCN(C2C4C3=C(C(=C(C(=C3OCC)OCC)OCC)N)C(=O)O4)C)OC)OCO5
• InChI: 1S/C26H32N2O8/c1-6-31-23-17-16(18(27)24(32-7-2)25(23)33-8-3)26(29)36-21(17)19-15-13(9-10-28(19)4)11-14-20(22(15)30-5)35-12-34-14/h11,19,21H,6-10,12,27H2,1-5H3
• InChIKey: IRGJVQIJENCTQF-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 647.2±55.0°C at 760 mmHg (Cal.)
• Flash point: 345.2±31.5°C (Cal.)