(6E)-6-[[6-(2-Dimethylaminoethyl)-1,3-Benzodioxol-5-Yl]Methylidene]-[1,3]Dioxolo[4,5-g]Isoindol-8-One
[CAS# 30341-99-2]

Identification

• Name: (6E)-6-[[6-(2-Dimethylaminoethyl)-1,3-Benzodioxol-5-Yl]Methylidene]-[1,3]Dioxolo[4,5-g]Isoindol-8-One
• Synonyms: (6E)-6-[[6-(2-Dimethylaminoethyl)-1,3-Benzodioxol-5-Yl]Methylene]-[1,3]Dioxolo[4,5-G]Isoindol-8-One; Fumaramine; 8H-1,3-Dioxolo(4,5-E)Isoindol-8-One, 6-((6-(2-(Dimethylamino)Ethyl)-1,3-Benzodioxol-5-Yl)Methylene)-6,7-Dihydro-
• Molecular Formula: C₂₁H₂₀N₂O₅
• Molecular Weight: 380.40
• CAS Registry Number: 30341-99-2
• SMILES: C1=C5C(=CC(=C1\C=C2/C4=C(C(N2)=O)C3=C(OCO3)C=C4)CCN(C)C)OCO5
• InChI: 1S/C21H20N2O5/c1-23(2)6-5-12-8-17-18(27-10-26-17)9-13(12)7-15-14-3-4-16-20(28-11-25-16)19(14)21(24)22-15/h3-4,7-9H,5-6,10-11H2,1-2H3,(H,22,24)/b15-7+
• InChIKey: ZURFNKDWDFKHSG-VIZOYTHASA-N

Properties

• Density: 1.387g/cm³ (Cal.)
• Boiling point: 624.449°C at 760 mmHg (Cal.)
• Flash point: 331.455°C (Cal.)