3-Hydroperoxy-3-methyl-1(3H)-isobenzofuranone
[CAS# 90094-81-8]

Identification

• Name: 3-Hydroperoxy-3-methyl-1(3H)-isobenzofuranone
• Synonyms: 3-Hydroperoxy-3-Methyl-Isobenzofuran-1-One; 3-Hydroperoxy-3-Methyl-1-Isobenzofuranone; 1(3H)-Isobenzofuranone, 3-Hydroperoxy-3-Methyl-
• Molecular Formula: C₉H₈O₄
• Molecular Weight: 180.16
• CAS Registry Number: 90094-81-8
• SMILES: C1=CC=CC2=C1C(OC2=O)(OO)C
• InChI: 1S/C9H8O4/c1-9(13-11)7-5-3-2-4-6(7)8(10)12-9/h2-5,11H,1H3
• InChIKey: UFQRCNSLWOCOQC-UHFFFAOYSA-N

Properties

• Density: 1.409g/cm³ (Cal.)
• Boiling point: 408.602°C at 760 mmHg (Cal.)
• Flash point: 173.425°C (Cal.)