D-Threo-Hexo-2,5-Diulosonic Acid

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Properties Simple | Detailed

Formula C6H8O7
IUPAC Name (3s,4s)-3,4,6-trihydroxy-2,5-dioxo-hexanoic acid
Molecular Mass 192.124 g·mol−1
Heat of Formation -1193.0 ± 16.7 kJ·mol−1
Dipole Moment 1.26 ± 1.08 D
Volume 201.61 Å 3
Surface Area 194.31 Å 2
HOMO Energy -10.70 ± 0.55 eV
LUMO Energy 1.97 ± eV
Point Group Symmetry C1
Synonyms
  • (3s,4s)-3,4,6-trihydroxy-2,5-diketo-hexanoic acid
  • (3s,4s)-3,4,6-trihydroxy-2,5-dioxo-hexanoic acid
  • (3s,4s)-3,4,6-trihydroxy-2,5-dioxohexanoic acid
  • 2,5-didehydro-d-gluconic acid
  • 2,5-diketogluconic acid
  • 2,5-dioxo-d-gluconic acid
  • d-threo-2,5-hexodiulosonic acid
CAS Number(s)
  • 2595-33-7
  • 159171-61-6
InChIKey RXMWXENJQAINCC-DMTCNVIQSA-N
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