Fosquidone
[CAS# 114517-02-1]

Identification

• Name: Fosquidone
• Synonyms: Benzyl (+-)-5,8,13,14-Tetrahydro-14-Methyl-8,13-Dioxobenz(5,6)Isoindolo(2,1-B)Isoquinolin-9-Yl Hydrogen Phosphate; Fosquidona [Inn-Spanish]; Fosquidone
• Molecular Formula: C₂₈H₂₂NO₆P
• Molecular Weight: 499.46
• CAS Registry Number: 114517-02-1
• SMILES: C1=C4C(=C2[N]1CC3=C(C2C)C=CC=C3)C(C5=C(C4=O)C(=CC=C5)O[P](OCC6=CC=CC=C6)(O)=O)=O
• InChI: 1S/C28H22NO6P/c1-17-20-11-6-5-10-19(20)14-29-15-22-25(26(17)29)27(30)21-12-7-13-23(24(21)28(22)31)35-36(32,33)34-16-18-8-3-2-4-9-18/h2-13,15,17H,14,16H2,1H3,(H,32,33)
• InChIKey: UXTSQCOOUJTIAC-UHFFFAOYSA-N

Properties

• Density: 1.451g/cm³ (Cal.)
• Boiling point: 729.421°C at 760 mmHg (Cal.)
• Flash point: 394.94°C (Cal.)