[(3S)-3-Methylhexanoyl] (1S,2S)-2-Methylcyclopropanecarboxylate

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Properties Simple | Detailed

Formula C12H20O3
IUPAC Name [(3s)-3-methylhexanoyl] (1s,2s)-2-methylcyclopropanecarboxylate
Molecular Mass 212.285 g·mol−1
Heat of Formation -614.5 ± 16.7 kJ·mol−1
Dipole Moment 3.86 ± 1.08 D
Volume 286.15 Å 3
Surface Area 274.57 Å 2
HOMO Energy -10.57 ± 0.55 eV
LUMO Energy 3.50 ± eV
Point Group Symmetry C1
InChIKey KWKXOMROVZHNNN-GUBZILKMSA-N
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Elements H C O