3-Methylbutanoyl 5-Methylhexanoate

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Properties Simple | Detailed

Formula C12H22O3
IUPAC Name 3-methylbutanoyl 5-methylhexanoate
Molecular Mass 214.301 g·mol−1
Heat of Formation -759.5 ± 16.7 kJ·mol−1
Dipole Moment 3.81 ± 1.08 D
Volume 296.98 Å 3
Surface Area 283.25 Å 2
HOMO Energy -10.61 ± 0.55 eV
LUMO Energy 0.29 ± eV
Point Group Symmetry C1
InChIKey WWIUYVVBKBILEA-UHFFFAOYSA-N
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Elements H C O