2-Ethoxy-3-hydroxy-6-methyl-2,4,6-cycloheptatrien-1-one
[CAS# 690233-45-5]

Identification

• Name: 2-Ethoxy-3-hydroxy-6-methyl-2,4,6-cycloheptatrien-1-one
• Synonyms: 2-ethoxy-3-hydroxy-6-methylcyclohepta-2,4,6-trienone; ZINC03851558
• Molecular Formula: C₁₀H₁₂O₃
• Molecular Weight: 180.20
• CAS Registry Number: 690233-45-5
• SMILES: O=C1/C=C(\C=CC(\O)=C1\OCC)C
• InChI: 1S/C10H12O3/c1-3-13-10-8(11)5-4-7(2)6-9(10)12/h4-6,11H,3H2,1-2H3
• InChIKey: VMZDDRDLPUOVDI-UHFFFAOYSA-N

Properties

• Density: 1.157g/cm³ (Cal.)
• Boiling point: 317.255°C at 760 mmHg (Cal.)
• Flash point: 125.238°C (Cal.)
• Refractive index: 1.538 (Cal.)