Ethyl (3S,4S)-3-(2-Ethoxy-2-Oxoethyl)-4-Isopropenyl-L-Prolinate

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Formula C14H23NO4
IUPAC Name ethyl (2s,3s,4s)-3-(2-ethoxy-2-oxo-ethyl)-4-isopropenyl-pyrrolidine-2-carboxylate
Molecular Mass 269.337 g·mol−1
Heat of Formation -777.3 ± 16.7 kJ·mol−1
Dipole Moment 1.14 ± 1.08 D
Volume 353.21 Å 3
Surface Area 294.25 Å 2
HOMO Energy -9.42 ± 0.55 eV
LUMO Energy 0.49 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s,4s)-3-(2-ethoxy-2-keto-ethyl)-4-isopropenyl-pyrrolidine-2-carboxylic acid ethyl ester
  • (2s,3s,4s)-3-(2-ethoxy-2-oxoethyl)-4-isopropenyl-2-pyrrolidinecarboxylic acid ethyl ester
  • 3-pyrrolidineacetic acid, 2-(ethoxycarbonyl)-4-(1-methylethenyl)-, ethyl ester, (2s-(2alpha,3beta,4beta))-
  • ethyl (2s,3s,4s)-3-(2-ethoxy-2-oxo-ethyl)-4-isopropenyl-pyrrolidine-2-carboxylate
  • ethyl (2s,3s,4s)-3-(2-ethoxy-2-oxo-ethyl)-4-prop-1-en-2-yl-pyrrolidine-2-carboxylate
  • kainic acid diethyl ester
CAS Number(s)
  • 66163-47-1
InChIKey WRMHXDMWMSVTBM-LOWVWBTDSA-N
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