S-Propyl 3-Methylbutanethioate

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Properties Simple | Detailed

Formula C8H16OS
IUPAC Name s-propyl 3-methylbutanethioate
Molecular Mass 160.277 g·mol−1
Heat of Formation -313.9 ± 16.7 kJ·mol−1
Dipole Moment 0.87 ± 1.08 D
Volume 221.33 Å 3
Surface Area 216.02 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy 2.61 ± eV
Point Group Symmetry C1
Synonyms
  • 3-methylbutanethioic acid s-propyl ester
  • butyric acid, 3-methylthio-, s-propyl ester
InChIKey NZRJNGAJWMNREL-UHFFFAOYSA-N
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Elements H C S O