[2-[(1S,2S)-2-Methylcyclopropyl]Acetyl] (2R)-2-Methylbutanoate

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Properties Simple | Detailed

Formula C11H18O3
IUPAC Name [2-[(1s,2s)-2-methylcyclopropyl]acetyl] (2r)-2-methylbutanoate
Molecular Mass 198.259 g·mol−1
Heat of Formation -592.4 ± 16.7 kJ·mol−1
Dipole Moment 4.49 ± 1.08 D
Volume 264.39 Å 3
Surface Area 255.11 Å 2
HOMO Energy -10.39 ± 0.55 eV
LUMO Energy 3.65 ± eV
Point Group Symmetry C1
InChIKey UOVRVGQYCZCIPX-VGMNWLOBSA-N
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