5-Ethoxy-2-methoxy-2,4,6-cycloheptatrien-1-one
[CAS# 714216-14-5]

Identification

• Name: 5-Ethoxy-2-methoxy-2,4,6-cycloheptatrien-1-one
• Synonyms: 5-ethoxy-2-methoxycyclohepta-2,4,6-trienone
• Molecular Formula: C₁₀H₁₂O₃
• Molecular Weight: 180.20
• CAS Registry Number: 714216-14-5
• SMILES: O=C1/C=C\C(=C/C=C1/OC)OCC
• InChI: 1S/C10H12O3/c1-3-13-8-4-6-9(11)10(12-2)7-5-8/h4-7H,3H2,1-2H3
• InChIKey: NHKLWBYLPXTBHJ-UHFFFAOYSA-N

Properties

• Density: 1.094g/cm³ (Cal.)
• Boiling point: 372.562°C at 760 mmHg (Cal.)
• Flash point: 170.521°C (Cal.)
• Refractive index: 1.509 (Cal.)