1-(2,2-Dimethylcyclopropyl)-5-Methyl-1-Hexanone

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Properties Simple | Detailed

Formula C12H22O
IUPAC Name 1-[(1s)-2,2-dimethylcyclopropyl]-5-methyl-hexan-1-one
Molecular Mass 182.302 g·mol−1
Heat of Formation -289.8 ± 16.7 kJ·mol−1
Dipole Moment 2.90 ± 1.08 D
Volume 271.57 Å 3
Surface Area 256.74 Å 2
HOMO Energy -9.90 ± 0.55 eV
LUMO Energy 3.86 ± eV
Point Group Symmetry C1
InChIKey KWSJCZWPRNBIDA-SNVBAGLBSA-N
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Elements H C O