[2-[(1S,2S)-2-Methylcyclopropyl]Acetyl] 3-Methylbutanoate

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Properties Simple | Detailed

Formula C11H18O3
IUPAC Name [2-[(1s,2s)-2-methylcyclopropyl]acetyl] 3-methylbutanoate
Molecular Mass 198.259 g·mol−1
Heat of Formation -595.2 ± 16.7 kJ·mol−1
Dipole Moment 4.45 ± 1.08 D
Volume 264.25 Å 3
Surface Area 255.87 Å 2
HOMO Energy -10.51 ± 0.55 eV
LUMO Energy 3.64 ± eV
Point Group Symmetry C1
InChIKey ZOXHLSMXBZEFNU-IUCAKERBSA-N
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Elements H C O