5-Methyl-1-[(1S,2R)-2-Methylcyclobutyl]Hexan-1-One

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Properties Simple | Detailed

Formula C12H22O
IUPAC Name 5-methyl-1-[(1s,2r)-2-methylcyclobutyl]hexan-1-one
Molecular Mass 182.302 g·mol−1
Heat of Formation -317.1 ± 16.7 kJ·mol−1
Dipole Moment 2.87 ± 1.08 D
Volume 268.83 Å 3
Surface Area 249.71 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy 3.97 ± eV
Point Group Symmetry C1
InChIKey VTWXWNYUNGMLFG-MNOVXSKESA-N
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Elements H C O