6-Methyl-5-Hepten-2-One

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Properties Simple | Detailed

Formula C8H14O
IUPAC Name 6-methylhept-5-en-2-one
Molecular Mass 126.196 g·mol−1
Heat of Formation -252.5 ± 16.7 kJ·mol−1
Dipole Moment 3.46 ± 1.08 D
Volume 186.22 Å 3
Surface Area 189.08 Å 2
HOMO Energy -9.39 ± 0.55 eV
LUMO Energy 3.98 ± eV
Point Group Symmetry C1
Synonyms
  • 2-methyl-2-hepten-6-one
  • 2-methyl-6-oxo-2-heptene
  • 2-oxo-6-methylhept-5-ene
  • 5-hepten-2-one, 6-methyl-
  • 6-methyl-5-hepten-2-one (natural)
  • 6-methyl-5-heptene-2-one
  • heptenone, methyl-
  • methyl heptenone
  • methylheptenone
  • sulcatone
CAS Number(s)
  • 110-93-0
  • 409-02-9
  • 129085-68-3
  • 132958-67-9
InChIKey UHEPJGULSIKKTP-UHFFFAOYSA-N
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