3,3-Dimethyl-2,5-Hexanedione

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Properties Simple | Detailed

Formula C8H14O2
IUPAC Name 3,3-dimethylhexane-2,5-dione
Molecular Mass 142.196 g·mol−1
Heat of Formation -465.2 ± 16.7 kJ·mol−1
Dipole Moment 4.83 ± 1.08 D
Volume 195.93 Å 3
Surface Area 182.1 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy 3.66 ± eV
Point Group Symmetry C1
Synonyms
  • 2,5-hexanedione, 3,3-dimethyl-
CAS Number(s)
  • 866-71-7
InChIKey CRVBWHZZWOZRCY-UHFFFAOYSA-N
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Elements H C O