3-[(2S)-2-Amino-2-Carboxyethyl]-2-Oxo-2H-Pyran-6-Carboxylic Acid

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Properties Simple | Detailed

Formula C9H9NO6
IUPAC Name 5-[(2s)-2-amino-2-carboxy-ethyl]-6-oxo-pyran-2-carboxylic acid
Molecular Mass 227.171 g·mol−1
Heat of Formation -938.3 ± 16.7 kJ·mol−1
Dipole Moment 3.16 ± 1.08 D
Volume 247.92 Å 3
Surface Area 231.09 Å 2
HOMO Energy -9.87 ± 0.55 eV
LUMO Energy -1.55 ± eV
Point Group Symmetry C1
Synonyms
  • 2h-pyran-3-propanoic acid, alpha-amino-6-carboxy-2-oxo-, (s)-
  • 5-[(2s)-2-amino-3-hydroxy-3-keto-propyl]-6-keto-pyran-2-carboxylic acid
  • 5-[(2s)-2-amino-3-hydroxy-3-oxo-propyl]-6-oxo-pyran-2-carboxylic acid
  • 5-[(2s)-2-amino-3-hydroxy-3-oxopropyl]-6-oxo-2-pyrancarboxylic acid
  • 5-[(2s)-2-amino-3-hydroxy-3-oxopropyl]-6-oxopyran-2-carboxylic acid
  • alpha-amino-6-carboxy-2-oxo-2h-pyran-3-propionic acid
CAS Number(s)
  • 17388-96-4
  • 23725-08-8
InChIKey GHFJNBYZGVNAOV-YFKPBYRVSA-N
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