1-[3,5-Bis(trifluoromethyl)phenyl]-5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-pentanone
[CAS# 898755-93-6]

Identification

• Name: 1-[3,5-Bis(trifluoromethyl)phenyl]-5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-pentanone
• Synonyms: bis-3',5'-trifluoromethyl-5-(5,5-dimethyl-1,3-dioxan-2-yl)valerophenone
• Molecular Formula: C₁₉H₂₂F₆O₃
• Molecular Weight: 412.37
• CAS Registry Number: 898755-93-6
• SMILES: FC(F)(F)c1cc(cc(c1)C(F)(F)F)C(=O)CCCCC2OCC(C)(C)CO2
• InChI: 1S/C19H22F6O3/c1-17(2)10-27-16(28-11-17)6-4-3-5-15(26)12-7-13(18(20,21)22)9-14(8-12)19(23,24)25/h7-9,16H,3-6,10-11H2,1-2H3
• InChIKey: JCLMYOUKBFDWDG-UHFFFAOYSA-N

Properties

• Density: 1.211g/cm³ (Cal.)
• Boiling point: 362.96°C at 760 mmHg (Cal.)
• Flash point: 167.454°C (Cal.)
• Refractive index: 1.436 (Cal.)