S-(2-Methyl-2-Propanyl) Propanethioate

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Properties Simple | Detailed

Formula C7H14OS
IUPAC Name s-tert-butyl propanethioate
Molecular Mass 146.250 g·mol−1
Heat of Formation -307.8 ± 16.7 kJ·mol−1
Dipole Moment 0.54 ± 1.08 D
Volume 196.35 Å 3
Surface Area 189.59 Å 2
HOMO Energy -9.10 ± 0.55 eV
LUMO Energy 2.66 ± eV
Point Group Symmetry Cs
Synonyms
  • propanethioic acid s-tert-butyl ester
  • s-tert-butyl propanethioate
InChIKey JEGFJPIEPWLJJM-UHFFFAOYSA-N
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Elements H C S O