4-Heptanone

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Properties Simple | Detailed

Formula C7H14O
IUPAC Name heptan-4-one
Molecular Mass 114.185 g·mol−1
Heat of Formation -308.9 ± 16.7 kJ·mol−1
Dipole Moment 3.26 ± 1.08 D
Volume 171.66 Å 3
Surface Area 177.34 Å 2
HOMO Energy -9.96 ± 0.55 eV
LUMO Energy 3.89 ± eV
Point Group Symmetry C2
Synonyms
  • 4-heptanone (natural)
  • butyrone
  • di(n-propyl) ketone
  • di-n-propyl ketone
  • dipropyl ketone
  • dipropyl ketone [un2710] [flammable liquid]
  • propyl ketone
CAS Number(s)
  • 123-19-3
InChIKey HCFAJYNVAYBARA-UHFFFAOYSA-N
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Elements H C O