D-Sorbosonic Acid

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Properties Simple | Detailed

Formula C6H10O7
IUPAC Name (3r,4s,5r)-3,4,5,6-tetrahydroxy-2-oxo-hexanoic acid
Molecular Mass 194.139 g·mol−1
Heat of Formation -1261.3 ± 16.7 kJ·mol−1
Dipole Moment 1.05 ± 1.08 D
Volume 209.22 Å 3
Surface Area 198.77 Å 2
HOMO Energy -10.57 ± 0.55 eV
LUMO Energy 2.22 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4s,5r)-3,4,5,6-tetrahydroxy-2-keto-hexanoic acid
  • (3r,4s,5r)-3,4,5,6-tetrahydroxy-2-oxo-hexanoic acid
  • (3r,4s,5r)-3,4,5,6-tetrahydroxy-2-oxohexanoic acid
  • xylo-2-hexulosonic acid
CAS Number(s)
  • 45079-74-1
InChIKey VBUYCZFBVCCYFD-FLRLBIABSA-N
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