5,5-Dimethyl-2-Phenyl-1,3-Dioxane
[CAS# 776-88-5]

Identification

• Name: 5,5-Dimethyl-2-Phenyl-1,3-Dioxane
• Synonyms: 1,3-Dioxane, 5,5-Dimethyl-2-Phenyl-; Benzaldehyde-, 2,2-Dimethyl-1,3-Propanediol Acetal; Nsc46263
• Molecular Formula: C₁₂H₁₆O₂
• Molecular Weight: 192.26
• CAS Registry Number: 776-88-5
• EINECS: 212-284-5
• SMILES: C1=CC(=CC=C1)C2OCC(CO2)(C)C
• InChI: 1S/C12H16O2/c1-12(2)8-13-11(14-9-12)10-6-4-3-5-7-10/h3-7,11H,8-9H2,1-2H3
• InChIKey: VUJMMVJKRWURKX-UHFFFAOYSA-N

Properties

• Density: 1.006g/cm³ (Cal.)
• Boiling point: 269.663°C at 760 mmHg (Cal.)
• Flash point: 121.66°C (Cal.)