[2-[(1R,2S)-2-Methylcyclobutyl]Acetyl] 3,3-Dimethylbutanoate

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Properties Simple | Detailed

Formula C13H22O3
IUPAC Name [2-[(1r,2s)-2-methylcyclobutyl]acetyl] 3,3-dimethylbutanoate
Molecular Mass 226.312 g·mol−1
Heat of Formation -683.8 ± 16.7 kJ·mol−1
Dipole Moment 4.37 ± 1.08 D
Volume 305.07 Å 3
Surface Area 284.26 Å 2
HOMO Energy -10.33 ± 0.55 eV
LUMO Energy 3.74 ± eV
Point Group Symmetry C1
InChIKey VWVGJOPRNPUWGE-VHSXEESVSA-N
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