10-(Acetyloxy)-4,5,6,7-Tetrahydro-2H-1-Benzoxecin-2,8(3H)-Dione
[CAS# 55129-60-7]

Identification

• Name: 10-(Acetyloxy)-4,5,6,7-Tetrahydro-2H-1-Benzoxecin-2,8(3H)-Dione
• Synonyms: Acetic Acid (2,8-Dioxo-4,5,6,7-Tetrahydro-3H-1-Benzoxecin-10-Yl) Ester; Acetic Acid (2,8-Diketo-4,5,6,7-Tetrahydro-3H-1-Benzoxecin-10-Yl) Ester; (2,8-Dioxo-4,5,6,7-Tetrahydro-3H-1-Benzoxecin-10-Yl) Ethanoate
• Molecular Formula: C₁₅H₁₆O₅
• Molecular Weight: 276.29
• CAS Registry Number: 55129-60-7
• SMILES: C1=C(C=CC2=C1C(CCCCCC(O2)=O)=O)OC(C)=O
• InChI: 1S/C15H16O5/c1-10(16)19-11-7-8-14-12(9-11)13(17)5-3-2-4-6-15(18)20-14/h7-9H,2-6H2,1H3
• InChIKey: GQIWVSJJJGSNGB-UHFFFAOYSA-N

Properties

• Density: 1.207g/cm³ (Cal.)
• Boiling point: 439.781°C at 760 mmHg (Cal.)
• Flash point: 196.282°C (Cal.)