1-O-(1-Naphthylacetyl)-β-D-Glucopyranose

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Properties Simple | Detailed

Formula C18H20O7
IUPAC Name [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] 2-(1-naphthyl)acetate
Molecular Mass 348.347 g·mol−1
Heat of Formation -1148.8 ± 16.7 kJ·mol−1
Dipole Moment 2.87 ± 1.08 D
Volume 401.7 Å 3
Surface Area 303.2 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -0.78 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(1-naphthyl)acetic acid [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl] ester
  • 2-(1-naphthyl)acetic acid [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-methylol-tetrahydropyran-2-yl] ester
  • [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 2-naphthalen-1-ylacetate
  • [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] 2-naphthalen-1-ylethanoate
  • [(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl] 2-(1-naphthyl)acetate
  • beta-d-glucopyranose, 1-(1-naphthaleneacetate)
  • beta-d-glucose 1-(1-naphthalene)acetate
  • glucose-1-(1-naphthalene)acetate
CAS Number(s)
  • 40681-78-5
  • 71239-72-0
InChIKey GSDPAPPLJYQPKZ-LHKMKVQPSA-N
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