Methyl (3S)-1-Methyl-4-Oxo-3-Piperidinecarboxylate

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Properties Simple | Detailed

Formula C8H13NO3
IUPAC Name methyl (1s,3s)-1-methyl-4-oxo-piperidine-3-carboxylate
Molecular Mass 171.194 g·mol−1
Heat of Formation -502.3 ± 16.7 kJ·mol−1
Dipole Moment 4.50 ± 1.08 D
Volume 208.95 Å 3
Surface Area 203.12 Å 2
HOMO Energy -9.40 ± 0.55 eV
LUMO Energy 0.73 ± eV
Point Group Symmetry C1
Synonyms
  • (3s)-1-methyl-4-oxo-3-piperidinecarboxylic acid methyl ester
  • (3s)-4-keto-1-methyl-nipecotic acid methyl ester
  • methyl (3s)-1-methyl-4-oxopiperidine-3-carboxylate
InChIKey BKCOINBLEJIZGR-LURJTMIESA-N
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