4-Methyl-1-Phenyl-2,6,7-Trioxabicyclo[2.2.2]Octane
[CAS# 70637-00-2]

Identification

• Name: 4-Methyl-1-Phenyl-2,6,7-Trioxabicyclo[2.2.2]Octane
• Synonyms: 2,6,7-Trioxabicyclo(2.2.2)Octane, 4-Methyl-1-Phenyl-; Brn 4439813; Orthobenzoic Acid, Cyclic Ester With 2-(Hydroxymethyl)-2-Methyl-1,3-Propanediol
• Molecular Formula: C₁₂H₁₄O₃
• Molecular Weight: 206.24
• CAS Registry Number: 70637-00-2
• SMILES: C1=CC=CC=C1C23OCC(CO2)(CO3)C
• InChI: 1S/C12H14O3/c1-11-7-13-12(14-8-11,15-9-11)10-5-3-2-4-6-10/h2-6H,7-9H2,1H3
• InChIKey: AABIHIQZAWJEDT-UHFFFAOYSA-N

Properties

• Density: 1.215g/cm³ (Cal.)
• Boiling point: 276.874°C at 760 mmHg (Cal.)
• Flash point: 91.543°C (Cal.)