Leptospermone

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Properties Simple | Detailed

Formula C15H22O4
IUPAC Name 2,2,4,4-tetramethyl-6-(3-methylbutanoyl)cyclohexane-1,3,5-trione
Molecular Mass 266.333 g·mol−1
Heat of Formation -805.5 ± 16.7 kJ·mol−1
Dipole Moment 1.32 ± 1.08 D
Volume 340.41 Å 3
Surface Area 280.98 Å 2
HOMO Energy -10.26 ± 0.55 eV
LUMO Energy 2.92 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3,5-cyclohexanetrione, 6-isovaleryl-2,2,4,4-tetramethyl-
  • 2,2,4,4-tetramethyl-6-(3-methyl-1-oxobutyl)cyclohexane-1,3,5-trione
  • 6-isovaleryl-2,2,4,4-tetramethyl-cyclohexane-1,3,5-trione
CAS Number(s)
  • 567-75-9
InChIKey YDWYMAHAWHBPPT-UHFFFAOYSA-N
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