(5S)-3,3,5-Trimethylcyclohexanone

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Properties Simple | Detailed

Formula C9H16O
IUPAC Name (5s)-3,3,5-trimethylcyclohexanone
Molecular Mass 140.223 g·mol−1
Heat of Formation -327.3 ± 16.7 kJ·mol−1
Dipole Moment 3.59 ± 1.08 D
Volume 200.91 Å 3
Surface Area 186.36 Å 2
HOMO Energy -9.88 ± 0.55 eV
LUMO Energy 1.01 ± eV
Point Group Symmetry C1
Synonyms
  • (5s)-3,3,5-trimethyl-1-cyclohexanone
  • (5s)-3,3,5-trimethylcyclohexan-1-one
InChIKey POSWICCRDBKBMH-SSDOTTSWSA-N
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Elements H C O