3,3-Dimethylpentanoyl (1S)-2,2-Dimethylcyclopropanecarboxylate

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Properties Simple | Detailed

Formula C13H22O3
IUPAC Name 3,3-dimethylpentanoyl (1s)-2,2-dimethylcyclopropanecarboxylate
Molecular Mass 226.312 g·mol−1
Heat of Formation -644.5 ± 16.7 kJ·mol−1
Dipole Moment 3.29 ± 1.08 D
Volume 306.11 Å 3
Surface Area 278.83 Å 2
HOMO Energy -10.45 ± 0.55 eV
LUMO Energy 3.59 ± eV
Point Group Symmetry C1
InChIKey VMBNDFHPOFCKAA-SECBINFHSA-N
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Elements H C O