5-Isopropyl-6-Methyl-2-(2-Methyl-2-Propanyl)-1,3-Dioxan-4-One
[CAS# 129287-66-7]

Identification

• Name: 5-Isopropyl-6-Methyl-2-(2-Methyl-2-Propanyl)-1,3-Dioxan-4-One
• Synonyms: 2-tert-Butyl-5-isopropyl-6-methyl-1,3-dioxan-4-one #
• Molecular Formula: C₁₂H₂₂O₃
• Molecular Weight: 214.30
• CAS Registry Number: 129287-66-7
• SMILES: O=C1OC(OC(C1C(C)C)C)C(C)(C)C
• InChI: 1S/C12H22O3/c1-7(2)9-8(3)14-11(12(4,5)6)15-10(9)13/h7-9,11H,1-6H3
• InChIKey: ZNQCVINNEKZFCC-UHFFFAOYSA-N

Properties

• Density: 0.959g/cm³ (Cal.)
• Boiling point: 291.87°C at 760 mmHg (Cal.)
• Flash point: 118.05°C (Cal.)
• Refractive index: 1.437 (Cal.)