S-(1-Methylcyclobutyl) 5-Methylhexanethioate

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Properties Simple | Detailed

Formula C12H22OS
IUPAC Name s-(1-methylcyclobutyl) 5-methylhexanethioate
Molecular Mass 214.367 g·mol−1
Heat of Formation -308.8 ± 16.7 kJ·mol−1
Dipole Moment 0.58 ± 1.08 D
Volume 295.16 Å 3
Surface Area 274.8 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy 2.62 ± eV
Point Group Symmetry C1
InChIKey JKOVISVHEORRKF-UHFFFAOYSA-N
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