S-Isopropyl Ethanethioate

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Properties Simple | Detailed

Formula C5H10OS
IUPAC Name s-isopropyl ethanethioate
Molecular Mass 118.197 g·mol−1
Heat of Formation -258.3 ± 16.7 kJ·mol−1
Dipole Moment 0.99 ± 1.08 D
Volume 155.26 Å 3
Surface Area 159.05 Å 2
HOMO Energy -9.16 ± 0.55 eV
LUMO Energy 2.58 ± eV
Point Group Symmetry C1
Synonyms
  • acetic acid, thio-, s-isopropyl ester
  • ethanethioic acid s-isopropyl ester
  • ethanethioic acid, s-(1-methylethyl) ester
  • s-propan-2-yl ethanethioate
CAS Number(s)
  • 926-73-8
InChIKey XBSWGFUCFLITEY-UHFFFAOYSA-N
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