3-Hydroxy-2-(Hydroxymethyl)-2-Methyl-Propanoic Acid, Isobenzofuran-1,3 -Dione
[CAS# 67953-40-6]

Identification

• Name: 3-Hydroxy-2-(Hydroxymethyl)-2-Methyl-Propanoic Acid, Isobenzofuran-1,3 -Dione
• Synonyms: 3-Hydroxy-2-(Hydroxymethyl)-2-Methyl-Propanoic Acid; Isobenzofuran-1,3-Dione; 3-Hydroxy-2-(Hydroxymethyl)-2-Methylpropanoic Acid; Isobenzofuran-1,3-Dione; 3-Hydroxy-2-Methyl-2-Methylol-Propionic Acid; Isobenzofuran-1,3-Quinone
• Molecular Formula: C₁₃H₁₄O₇
• Molecular Weight: 282.25
• CAS Registry Number: 67953-40-6
• SMILES: C1=CC=CC2=C1C(OC2=O)=O.C(O)C(C(=O)O)(CO)C
• InChI: 1S/C8H4O3.C5H10O4/c9-7-5-3-1-2-4-6(5)8(10)11-7;1-5(2-6,3-7)4(8)9/h1-4H;6-7H,2-3H2,1H3,(H,8,9)
• InChIKey: FMMLQRMJHDOODA-UHFFFAOYSA-N

Properties

• Boiling point: 295°C at 760 mmHg (Cal.)
• Flash point: 139.7°C (Cal.)