2-Deoxy-2-[(Trifluoroacetyl)Amino]-β-D-Galactopyranose

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Formula C8H12F3NO6
IUPAC Name 2,2,2-trifluoro-n-[(2r,3r,4r,5r,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
Molecular Mass 275.179 g·mol−1
Heat of Formation -1759.3 ± 16.7 kJ·mol−1
Dipole Moment 3.10 ± 1.08 D
Volume 278.58 Å 3
Surface Area 250.89 Å 2
HOMO Energy -10.45 ± 0.55 eV
LUMO Energy -0.08 ± eV
Point Group Symmetry C1
Synonyms
  • 2,2,2-trifluoro-n-[(2r,3r,4r,5r,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl]acetamide
  • 2,2,2-trifluoro-n-[(2r,3r,4r,5r,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]ethanamide
  • 2,2,2-trifluoro-n-[(2r,3r,4r,5r,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
  • 2,2,2-trifluoro-n-[(2r,3r,4r,5r,6r)-2,4,5-trihydroxy-6-methylol-tetrahydropyran-3-yl]acetamide
  • n-trifluoro-galnac
  • n-trifluoroacetylgalactosamine
CAS Number(s)
  • 117766-36-6
InChIKey ZXNYUXIMAXVSFN-VFUOTHLCSA-N
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