8,9-Dihydro-5,8-Dihydroxy-8-Hydroxymethyl-2-Methyl-4H-Pyrano[3,2-h][1]Benzoxepin-4-One
[CAS# 18836-12-9]

Identification

• Name: 8,9-Dihydro-5,8-Dihydroxy-8-Hydroxymethyl-2-Methyl-4H-Pyrano[3,2-h][1]Benzoxepin-4-One
• Synonyms: 5,8-Dihydroxy-2-Methyl-8-Methylol-9H-Oxepino[3,2-G]Chromen-4-One; C09030; Ptaeroglycol
• Molecular Formula: C₁₅H₁₄O₆
• Molecular Weight: 290.27
• CAS Registry Number: 18836-12-9
• SMILES: C2=C1OC(=CC(=O)C1=C(O)C3=C2OCC(O)(C=C3)CO)C
• InChI: 1S/C15H14O6/c1-8-4-10(17)13-12(21-8)5-11-9(14(13)18)2-3-15(19,6-16)7-20-11/h2-5,16,18-19H,6-7H2,1H3
• InChIKey: IVVDHMXDSFGHMC-UHFFFAOYSA-N

Properties

• Density: 1.478g/cm³ (Cal.)
• Boiling point: 557.359°C at 760 mmHg (Cal.)
• Flash point: 213.986°C (Cal.)