[(3S)-3-Methylhexanoyl] 1-Methylcyclobutanecarboxylate

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Properties Simple | Detailed

Formula C13H22O3
IUPAC Name [(3s)-3-methylhexanoyl] 1-methylcyclobutanecarboxylate
Molecular Mass 226.312 g·mol−1
Heat of Formation -675.7 ± 16.7 kJ·mol−1
Dipole Moment 4.15 ± 1.08 D
Volume 307.76 Å 3
Surface Area 284.7 Å 2
HOMO Energy -10.42 ± 0.55 eV
LUMO Energy 3.62 ± eV
Point Group Symmetry C1
InChIKey RIBSBJIEOXBAOP-JTQLQIEISA-N
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Elements H C O