2,3-Dihydroxy-2,4,6-Cycloheptatrien-1-One

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Properties Simple | Detailed

Formula C7H6O3
IUPAC Name 2,3-dihydroxycyclohepta-2,4,6-trien-1-one
Molecular Mass 138.121 g·mol−1
Heat of Formation -329.1 ± 16.7 kJ·mol−1
Dipole Moment 2.94 ± 1.08 D
Volume 153.59 Å 3
Surface Area 157.56 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -1.27 ± eV
Point Group Symmetry C1
Synonyms
  • 2,3-dihydroxy-1-cyclohepta-2,4,6-trienone
  • 2,4,6-cycloheptatrien-1-one, 2,3-dihydroxy-
  • 2,4,6-cycloheptatrien-1-one, 2,7-dihydroxy-
  • 2,7-dihydroxy-2,4,6-cycloheptatrien-1-one
  • 3-hydroxytropolone
  • 7-hydroxytropolone
CAS Number(s)
  • 33739-50-3
  • 34777-04-3
InChIKey ABNPYUDYGCGOTK-UHFFFAOYSA-N
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