4,4-Dimethyl-3-Hexanone

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Properties Simple | Detailed

Formula C8H16O
IUPAC Name 4,4-dimethylhexan-3-one
Molecular Mass 128.212 g·mol−1
Heat of Formation -326.3 ± 16.7 kJ·mol−1
Dipole Moment 3.03 ± 1.08 D
Volume 188.9 Å 3
Surface Area 181.6 Å 2
HOMO Energy -9.73 ± 0.55 eV
LUMO Energy 4.04 ± eV
Point Group Symmetry Cs
Synonyms
  • 3-hexanone, 4,4-dimethyl-
CAS Number(s)
  • 19550-14-2
InChIKey YEDJXYBDQSVPFJ-UHFFFAOYSA-N
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Elements H C O