[(2S)-4-Hydroxy-5-Oxo-2,5-Dihydro-2-Furanyl]Acetyl Hydrogen Carbonate

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Properties Simple | Detailed

Formula C7H6O7
IUPAC Name carboxy 2-[(2s)-4-hydroxy-5-oxo-2h-furan-2-yl]acetate
Molecular Mass 202.118 g·mol−1
Heat of Formation -1096.1 ± 16.7 kJ·mol−1
Dipole Moment 3.81 ± 1.08 D
Volume 204.78 Å 3
Surface Area 208.71 Å 2
HOMO Energy -10.51 ± 0.55 eV
LUMO Energy -1.21 ± eV
Point Group Symmetry C1
Synonyms
  • 1-keto-2,4-dihydroxy-4-carboxyadipenoic acid (2,3)-1,4-lactone
  • 2-[(2s)-4-hydroxy-5-keto-2h-furan-2-yl]acetic acid carboxy ester
  • 2-[(2s)-4-hydroxy-5-oxo-2h-furan-2-yl]acetic acid carboxy ester
  • 2-furanacetic acid, 2-carboxy-2,5-dihydro-4-hydroxy-5-oxo-, (s)-
  • carboxy 2-[(2s)-4-hydroxy-5-oxo-2h-furan-2-yl]acetate
  • carboxy 2-[(2s)-4-hydroxy-5-oxo-2h-furan-2-yl]ethanoate
  • citroylformic acid-gamma-lactone
CAS Number(s)
  • 67055-62-3
InChIKey WAEYLBYMNVAENL-GSVOUGTGSA-N
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Elements H C O