5-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(4-pentylphenyl)-1-pentanone
[CAS# 898755-48-1]

Identification

• Name: 5-(5,5-Dimethyl-1,3-dioxan-2-yl)-1-(4-pentylphenyl)-1-pentanone
• Synonyms: 5-(5,5-dimethyl-1,3-dioxan-2-yl)-4'-pentylvalerophenone
• Molecular Formula: C₂₂H₃₄O₃
• Molecular Weight: 346.50
• CAS Registry Number: 898755-48-1
• SMILES: CCCCCc1ccc(cc1)C(=O)CCCCC2OCC(C)(C)CO2
• InChI: 1S/C22H34O3/c1-4-5-6-9-18-12-14-19(15-13-18)20(23)10-7-8-11-21-24-16-22(2,3)17-25-21/h12-15,21H,4-11,16-17H2,1-3H3
• InChIKey: OLEIAVHEZNDACV-UHFFFAOYSA-N

Properties

• Density: 0.974g/cm³ (Cal.)
• Boiling point: 458.725°C at 760 mmHg (Cal.)
• Flash point: 223.256°C (Cal.)
• Refractive index: 1.488 (Cal.)