3-Deoxy-D-Erythro-Hex-2-Ulose

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Properties Simple | Detailed

Formula C6H12O5
IUPAC Name (4s,5r)-1,4,5,6-tetrahydroxyhexan-2-one
Molecular Mass 164.156 g·mol−1
Heat of Formation -963.4 ± 16.7 kJ·mol−1
Dipole Moment 4.27 ± 1.08 D
Volume 191.87 Å 3
Surface Area 188.25 Å 2
HOMO Energy -10.36 ± 0.55 eV
LUMO Energy 3.34 ± eV
Point Group Symmetry C1
Synonyms
  • (4s,5r)-1,4,5,6-tetrahydroxyhexan-2-one
  • 3-deoxy-d-erythro-hexulose
  • 3-deoxyfructose
  • 3-deoxyhexulose
  • d-erythro-2-hexulose, 3-deoxy-
CAS Number(s)
  • 6196-57-2
InChIKey OXFWZSUJNURRMW-NTSWFWBYSA-N
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Elements H C O