S-(2-Acetamidoethyl) (3E)-3-Decenethioate

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Formula C14H25NO2S
IUPAC Name s-(2-acetamidoethyl) (e)-dec-3-enethioate
Molecular Mass 271.419 g·mol−1
Heat of Formation -496.2 ± 16.7 kJ·mol−1
Dipole Moment 4.36 ± 1.08 D
Volume 372.24 Å 3
Surface Area 292.77 Å 2
HOMO Energy -9.24 ± 0.55 eV
LUMO Energy -0.61 ± eV
Point Group Symmetry C1
Synonyms
  • (e)-dec-3-enethioic acid s-(2-acetamidoethyl) ester
  • 3-decenethioic acid, s-(2-(acetylamino)ethyl) ester
  • 3-decenoic acid n-ethylcysteamine thioester
  • 3-decenoic-nacs
  • s-(2-acetamidoethyl) (e)-dec-3-enethioate
CAS Number(s)
  • 15469-76-8
InChIKey CVOBRLAYVGOYCM-CMDGGOBGSA-N
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