Methyl 2-Hexyl-3-Oxocyclopentanecarboxylate

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Properties Simple | Detailed

Formula C13H22O3
IUPAC Name methyl (1r,2s)-2-hexyl-3-oxo-cyclopentanecarboxylate
Molecular Mass 226.312 g·mol−1
Heat of Formation -699.8 ± 16.7 kJ·mol−1
Dipole Moment 2.74 ± 1.08 D
Volume 304.44 Å 3
Surface Area 282.44 Å 2
HOMO Energy -10.13 ± 0.55 eV
LUMO Energy 3.76 ± eV
Point Group Symmetry C1
InChIKey IPWBXORAIBJDDQ-WDEREUQCSA-N
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Elements H C O