2-Deoxy-2-Fluoro-3-O-Methyl-D-Glucose

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Properties Simple | Detailed

Formula C7H13FO5
IUPAC Name (2r,3s,4r,5r)-2-fluoro-4,5,6-trihydroxy-3-methoxy-hexanal
Molecular Mass 196.174 g·mol−1
Heat of Formation -1046.1 ± 16.7 kJ·mol−1
Dipole Moment 7.23 ± 1.08 D
Volume 224.85 Å 3
Surface Area 211.04 Å 2
HOMO Energy -9.97 ± 0.55 eV
LUMO Energy 0.59 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3s,4r,5r)-2-fluoro-4,5,6-trihydroxy-3-methoxy-hexanal
  • (2r,3s,4r,5r)-2-fluoro-4,5,6-trihydroxy-3-methoxyhexanal
InChIKey QLNYZPSEJLQQSX-BDVNFPICSA-N
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