1-(3-Bromo-4-chlorophenyl)-5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-pentanone
[CAS# 898757-26-1]

Identification

• Name: 1-(3-Bromo-4-chlorophenyl)-5-(5,5-dimethyl-1,3-dioxan-2-yl)-1-pentanone
• Synonyms: 3'-bromo-4'-chloro-5-(5,5-dimethyl-1,3-dioxan-2-yl)valerophenone
• Molecular Formula: C₁₇H₂₂BrClO₃
• Molecular Weight: 389.71
• CAS Registry Number: 898757-26-1
• SMILES: Clc1ccc(cc1Br)C(=O)CCCCC2OCC(C)(C)CO2
• InChI: 1S/C17H22BrClO3/c1-17(2)10-21-16(22-11-17)6-4-3-5-15(20)12-7-8-14(19)13(18)9-12/h7-9,16H,3-6,10-11H2,1-2H3
• InChIKey: RPIGWEKFDBXFKV-UHFFFAOYSA-N

Properties

• Density: 1.292g/cm³ (Cal.)
• Boiling point: 466.604°C at 760 mmHg (Cal.)
• Flash point: 235.994°C (Cal.)
• Refractive index: 1.52 (Cal.)