2,6-Dimethylocta-5,7-Dien-4-One

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Properties Simple | Detailed

Formula C10H16O
IUPAC Name (5e)-2,6-dimethylocta-5,7-dien-4-one
Molecular Mass 152.233 g·mol−1
Heat of Formation -174.2 ± 16.7 kJ·mol−1
Dipole Moment 2.57 ± 1.08 D
Volume 222.48 Å 3
Surface Area 210.4 Å 2
HOMO Energy -9.74 ± 0.55 eV
LUMO Energy 2.82 ± eV
Point Group Symmetry C1
Synonyms
  • (5e)-2,6-dimethylocta-5,7-dien-4-one
  • (e)-2,6-dimethylocta-5,7-dien-4-one
  • (z)-2,6-dimethylocta-5,7-dien-4-one
  • 2,6-dimethyl-5,7-octadien-4-one
  • 5,7-octadien-4-one, 2,6-dimethyl-
  • 5,7-octadien-4-one, 2,6-dimethyl-, (z)-
  • cis-tagetone
  • tagetone
CAS Number(s)
  • 3588-18-9
  • 6752-80-3
  • 23985-25-3
InChIKey RJXKHBTYHGBOKV-VQHVLOKHSA-N
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Elements H C O