S-Ethyl 3-Methylbutanethioate

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Properties Simple | Detailed

Formula C7H14OS
IUPAC Name s-ethyl 3-methylbutanethioate
Molecular Mass 146.250 g·mol−1
Heat of Formation -292.4 ± 16.7 kJ·mol−1
Dipole Moment 0.98 ± 1.08 D
Volume 199.28 Å 3
Surface Area 196.34 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy 2.62 ± eV
Point Group Symmetry C1
Synonyms
  • 3-methylbutanethioic acid s-ethyl ester
  • butanethioic acid, 3-methyl-, s-ethyl ester
  • butyric acid, 3-methylthio-, s-ethyl ester
InChIKey SFIBIFKKWPWUGL-UHFFFAOYSA-N
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Elements H C S O