3-(Tert-Butyldioxy)-3-Phenylphthalide
[CAS# 25251-51-8]

Identification

• Name: 3-(Tert-Butyldioxy)-3-Phenylphthalide
• Synonyms: 3-Tert-Butylperoxy-3-Phenyl-Isobenzofuran-1-One; 3-Tert-Butyldioxy-3-Phenyl-1-Isobenzofuranone; 3-(Tert-Butyldioxy)-3-Phenylphthalide
• Molecular Formula: C₁₈H₁₈O₄
• Molecular Weight: 298.34
• CAS Registry Number: 25251-51-8
• EINECS: 246-759-3
• SMILES: C1=CC=CC2=C1C(OC2=O)(OOC(C)(C)C)C3=CC=CC=C3
• InChI: 1S/C18H18O4/c1-17(2,3)21-22-18(13-9-5-4-6-10-13)15-12-8-7-11-14(15)16(19)20-18/h4-12H,1-3H3
• InChIKey: JJHHIGCUQPTUHO-UHFFFAOYSA-N

Properties

• Density: 1.215g/cm³ (Cal.)
• Boiling point: 427.893°C at 760 mmHg (Cal.)
• Flash point: 188.64°C (Cal.)