1-(3,4-Difluorophenyl)-5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-pentanone
[CAS# 898786-99-7]

Identification

• Name: 1-(3,4-Difluorophenyl)-5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-pentanone
• Synonyms: 3',4'-difluoro-5-(5,5-dimethyl-1,3-dioxan-2-yl)valerophenone
• Molecular Formula: C₁₇H₂₂F₂O₃
• Molecular Weight: 312.35
• CAS Registry Number: 898786-99-7
• SMILES: Fc1ccc(cc1F)C(=O)CCCCC2OCC(C)(C)CO2
• InChI: 1S/C17H22F2O3/c1-17(2)10-21-16(22-11-17)6-4-3-5-15(20)12-7-8-13(18)14(19)9-12/h7-9,16H,3-6,10-11H2,1-2H3
• InChIKey: KFTXANYBDMLOMW-UHFFFAOYSA-N

Properties

• Density: 1.108g/cm³ (Cal.)
• Boiling point: 394.863°C at 760 mmHg (Cal.)
• Flash point: 185.948°C (Cal.)
• Refractive index: 1.473 (Cal.)