(3S)-1-Ethyl-3-Piperidinyl Diphenylacetate

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Properties Simple | Detailed

Formula C21H25NO2
IUPAC Name [(1r,3s)-1-ethyl-3-piperidyl] 2,2-diphenylacetate
Molecular Mass 323.429 g·mol−1
Heat of Formation -214.4 ± 16.7 kJ·mol−1
Dipole Moment 2.70 ± 1.08 D
Volume 411.24 Å 3
Surface Area 363.96 Å 2
HOMO Energy -8.81 ± 0.55 eV
LUMO Energy 0.01 ± eV
Point Group Symmetry C1
Synonyms
  • 2,2-di(phenyl)acetic acid [(3s)-1-ethyl-3-piperidinyl] ester
  • 2,2-di(phenyl)acetic acid [(3s)-1-ethyl-3-piperidyl] ester
  • [(3s)-1-ethyl-3-piperidyl] 2,2-di(phenyl)acetate
  • [(3s)-1-ethylpiperidin-3-yl] 2,2-di(phenyl)acetate
  • [(3s)-1-ethylpiperidin-3-yl] 2,2-di(phenyl)ethanoate
InChIKey KTHVBAZBLKXIHZ-IBGZPJMESA-N
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