3-(1,3-Dioxan-2-yl)-1-(4-heptylphenyl)-1-propanone
[CAS# 898787-19-4]

Identification

• Name: 3-(1,3-Dioxan-2-yl)-1-(4-heptylphenyl)-1-propanone
• Synonyms: 3-(1,3-dioxan-2-yl)-4'-heptylpropiophenone
• Molecular Formula: C₂₀H₃₀O₃
• Molecular Weight: 318.45
• CAS Registry Number: 898787-19-4
• SMILES: CCCCCCCc1ccc(cc1)C(=O)CCC2OCCCO2
• InChI: 1S/C20H30O3/c1-2-3-4-5-6-8-17-9-11-18(12-10-17)19(21)13-14-20-22-15-7-16-23-20/h9-12,20H,2-8,13-16H2,1H3
• InChIKey: YZGQUWYFQRBHPK-UHFFFAOYSA-N

Properties

• Density: 1.003g/cm³ (Cal.)
• Boiling point: 448.584°C at 760 mmHg (Cal.)
• Flash point: 217.049°C (Cal.)
• Refractive index: 1.499 (Cal.)