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

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Properties Simple | Detailed

Formula C13H22O3
IUPAC Name [2-[(1s)-2,2-dimethylcyclobutyl]acetyl] (2r)-2-methylbutanoate
Molecular Mass 226.312 g·mol−1
Heat of Formation -681.4 ± 16.7 kJ·mol−1
Dipole Moment 4.42 ± 1.08 D
Volume 306.75 Å 3
Surface Area 283.36 Å 2
HOMO Energy -10.39 ± 0.55 eV
LUMO Energy 3.67 ± eV
Point Group Symmetry C1
InChIKey HRNSDVINAMBZPM-ZJUUUORDSA-N
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