2,3-Dihydroxycyclohepta-2,4,6-Trien-1-One
[CAS# 33739-50-3]

Identification

• Name: 2,3-Dihydroxycyclohepta-2,4,6-Trien-1-One
• Synonyms: 2,3-Dihydroxy-1-Cyclohepta-2,4,6-Trienone; 2,4,6-Cycloheptatrien-1-One, 2,3-Dihydroxy-; 3-Hydroxytropolone
• Molecular Formula: C₇H₆O₃
• Molecular Weight: 138.12
• CAS Registry Number: 33739-50-3
• SMILES: O=C1C(=C(C=CC=C1)O)O
• InChI: 1S/C7H6O3/c8-5-3-1-2-4-6(9)7(5)10/h1-4H,(H2,8,9,10)
• InChIKey: ABNPYUDYGCGOTK-UHFFFAOYSA-N

Properties

• Density: 1.526g/cm³ (Cal.)
• Boiling point: 272.827°C at 760 mmHg (Cal.)
• Flash point: 133.048°C (Cal.)

References

• (1): K. Kubo, T. Matsumoto and A. Mori. 3-Hydroxytropolone (2,7-dihydroxycyclohepta-2,4,6-trien-1-one), Acta Cryst. (2007). E63, o941-o943