5-Methyl-2-Hexanone

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Properties Simple | Detailed

Formula C7H14O
IUPAC Name 5-methylhexan-2-one
Molecular Mass 114.185 g·mol−1
Heat of Formation -315.2 ± 16.7 kJ·mol−1
Dipole Moment 3.09 ± 1.08 D
Volume 171.01 Å 3
Surface Area 175.33 Å 2
HOMO Energy -10.09 ± 0.55 eV
LUMO Energy 3.97 ± eV
Point Group Symmetry C1
Synonyms
  • 2-hexanone, 5-methyl-
  • 2-methyl-5-hexanone
  • 5-methylhexan-2-one [un2302] [flammable liquid]
  • isoamyl methyl ketone
  • isobutylacetone
  • isopentyl methyl ketone
  • ketone, methyl isoamyl
  • methyl isoamyl ketone
  • methyl isopentyl ketone
  • miak
CAS Number(s)
  • 110-12-3
InChIKey FFWSICBKRCICMR-UHFFFAOYSA-N
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Elements H C O