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

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Properties Simple | Detailed

Formula C13H22O3
IUPAC Name [2-[(1s,2r)-2-methylcyclobutyl]acetyl] (2r)-2-methylpentanoate
Molecular Mass 226.312 g·mol−1
Heat of Formation -676.9 ± 16.7 kJ·mol−1
Dipole Moment 4.11 ± 1.08 D
Volume 307.2 Å 3
Surface Area 291.29 Å 2
HOMO Energy -10.42 ± 0.55 eV
LUMO Energy 3.65 ± eV
Point Group Symmetry C1
InChIKey GDTYOMZWLCAWLZ-MXWKQRLJSA-N
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