5-[2-(1,3-Dioxoisobenzofuran-5-Yl)Propan-2-Yl]Isobenzofuran-1,3-Dione
[CAS# 1779-17-5]

Identification

• Name: 5-[2-(1,3-Dioxoisobenzofuran-5-Yl)Propan-2-Yl]Isobenzofuran-1,3-Dione
• Synonyms: 5-[1-(1,3-Dioxoisobenzofuran-5-Yl)-1-Methyl-Ethyl]Isobenzofuran-1,3-Dione; 5-[1-(1,3-Dioxo-5-Isobenzofuranyl)-1-Methylethyl]Isobenzofuran-1,3-Dione; 5-[1-(1,3-Diketoisobenzofuran-5-Yl)-1-Methyl-Ethyl]Isobenzofuran-1,3-Quinone
• Molecular Formula: C₁₉H₁₂O₆
• Molecular Weight: 336.30
• CAS Registry Number: 1779-17-5
• SMILES: C1=C4C(=CC=C1C(C2=CC=C3C(=C2)C(OC3=O)=O)(C)C)C(OC4=O)=O
• InChI: 1S/C19H12O6/c1-19(2,9-3-5-11-13(7-9)17(22)24-15(11)20)10-4-6-12-14(8-10)18(23)25-16(12)21/h3-8H,1-2H3
• InChIKey: ALTVSEFNOLOASZ-UHFFFAOYSA-N

Properties

• Density: 1.469g/cm³ (Cal.)
• Boiling point: 559.232°C at 760 mmHg (Cal.)
• Flash point: 249.229°C (Cal.)