1-Benzoxepin-3,5(2H,4H)-Dione
[CAS# 62557-53-3]

Identification

• Name: 1-Benzoxepin-3,5(2H,4H)-Dione
• Synonyms: 1-Benzoxepine-3,5-Quinone; 1-Benzoxepin-3,5(2H,4H)-Dione
• Molecular Formula: C₁₀H₈O₃
• Molecular Weight: 176.17
• CAS Registry Number: 62557-53-3
• EINECS: 263-595-8
• SMILES: C1=C2C(=CC=C1)OCC(=O)CC2=O
• InChI: 1S/C10H8O3/c11-7-5-9(12)8-3-1-2-4-10(8)13-6-7/h1-4H,5-6H2
• InChIKey: VXHBBPNYWKGNHL-UHFFFAOYSA-N

Properties

• Density: 1.276g/cm³ (Cal.)
• Boiling point: 353.641°C at 760 mmHg (Cal.)
• Flash point: 160.69°C (Cal.)