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

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Properties Simple | Detailed

Formula C13H24O
IUPAC Name 1-[(1s)-2,2-dimethylcyclobutyl]-5-methyl-hexan-1-one
Molecular Mass 196.329 g·mol−1
Heat of Formation -349.1 ± 16.7 kJ·mol−1
Dipole Moment 3.07 ± 1.08 D
Volume 292.59 Å 3
Surface Area 264.85 Å 2
HOMO Energy -9.82 ± 0.55 eV
LUMO Energy 4.00 ± eV
Point Group Symmetry C1
InChIKey ZJCSPHHSPWNHDN-LLVKDONJSA-N
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Elements H C O