2,2'-Methylenedicyclohexane-1,3-Dione

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Properties Simple | Detailed

Formula C13H16O4
IUPAC Name 2-[(2,6-dioxocyclohexyl)methyl]cyclohexane-1,3-dione
Molecular Mass 236.264 g·mol−1
Heat of Formation -729.7 ± 16.7 kJ·mol−1
Dipole Moment 4.80 ± 1.08 D
Volume 282.88 Å 3
Surface Area 248.81 Å 2
HOMO Energy -10.25 ± 0.55 eV
LUMO Energy 0.29 ± eV
Point Group Symmetry C2
Synonyms
  • 2,2′-methylenebis(1,3-cyclohexanedione)
  • 2,2'-methylenebis(cyclohexane-1,3-dione)
  • 2-[(2,6-diketocyclohexyl)methyl]cyclohexane-1,3-quinone
  • apoptosis inhibitor
  • enamine_000755
  • hsci1_000071
  • m50054
CAS Number(s)
  • 54135-60-3
InChIKey ILUMEPMGPCKGHH-UHFFFAOYSA-N
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