[2-[(1S)-2,2-Dimethylcyclopropyl]Acetyl] (2S)-2-Methylpentanoate

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Properties Simple | Detailed

Formula C13H22O3
IUPAC Name [2-[(1s)-2,2-dimethylcyclopropyl]acetyl] (2s)-2-methylpentanoate
Molecular Mass 226.312 g·mol−1
Heat of Formation -642.4 ± 16.7 kJ·mol−1
Dipole Moment 4.39 ± 1.08 D
Volume 308.92 Å 3
Surface Area 293.62 Å 2
HOMO Energy -10.30 ± 0.55 eV
LUMO Energy 3.67 ± eV
Point Group Symmetry C1
InChIKey DPOAKQZOMAHQBV-VHSXEESVSA-N
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