1,3-Cyclohexanedione

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Properties Simple | Detailed

Formula C6H8O2
IUPAC Name cyclohexane-1,3-dione
Molecular Mass 112.127 g·mol−1
Heat of Formation -375.4 ± 16.7 kJ·mol−1
Dipole Moment 3.66 ± 1.08 D
Volume 136.84 Å 3
Surface Area 143.07 Å 2
HOMO Energy -10.44 ± 0.55 eV
LUMO Energy 3.47 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,3 cyclohexanedione
  • 1,3-benzenediol, dihydro-
  • 1,3-cyclohexandione
  • 1,3-cyclohexanone
  • cyclohexane-1,3-quinone
  • dihydroresorcinol
  • hydroresorcinol
  • resorcinol, dihydro-
  • sb 01019
CAS Number(s)
  • 504-02-9
InChIKey HJSLFCCWAKVHIW-UHFFFAOYSA-N
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Elements H C O