S-[(1R,2R)-2-Methylcyclobutyl] 5-Methylhexanethioate

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Properties Simple | Detailed

Formula C12H22OS
IUPAC Name s-[(1r,2r)-2-methylcyclobutyl] 5-methylhexanethioate
Molecular Mass 214.367 g·mol−1
Heat of Formation -304.6 ± 16.7 kJ·mol−1
Dipole Moment 0.80 ± 1.08 D
Volume 296.19 Å 3
Surface Area 280.79 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy 2.64 ± eV
Point Group Symmetry C1
InChIKey UDLBLEKRORRTAU-GHMZBOCLSA-N
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