S-Isopentyl Propanethioate

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Properties Simple | Detailed

Formula C8H16OS
IUPAC Name s-isopentyl propanethioate
Molecular Mass 160.277 g·mol−1
Heat of Formation -310.0 ± 16.7 kJ·mol−1
Dipole Moment 0.84 ± 1.08 D
Volume 220.01 Å 3
Surface Area 218.01 Å 2
HOMO Energy -9.12 ± 0.55 eV
LUMO Energy 2.57 ± eV
Point Group Symmetry C1
Synonyms
  • propanethioic acid s-isoamyl ester
  • propanethioic acid s-isopentyl ester
  • propionic acid, thio-, s-isopentyl ester
  • s-(3-methylbutyl) propanethioate
InChIKey ZRKSTUORYFTABS-UHFFFAOYSA-N
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Elements H C S O