4-Aminophenyl β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C12H17NO6
IUPAC Name (2s,3r,4s,5s,6r)-2-(4-aminophenoxy)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 271.266 g·mol−1
Heat of Formation -990.3 ± 16.7 kJ·mol−1
Dipole Moment 1.31 ± 1.08 D
Volume 309.44 Å 3
Surface Area 273.89 Å 2
HOMO Energy -8.44 ± 0.55 eV
LUMO Energy 0.11 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r,4s,5s,6r)-2-(4-aminophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
  • (2s,3r,4s,5s,6r)-2-(4-aminophenoxy)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2s,3r,4s,5s,6r)-2-(4-aminophenoxy)-6-methylol-tetrahydropyran-3,4,5-triol
  • .beta.-d-glucopyranoside, 4-aminophenyl
  • 4-aminophenyl glucoside
  • 4-aminophenyl-beta-d-glucopyranoside
  • beta-d-glucopyranoside, 4-aminophenyl
  • p-aminophenyl-beta-d-glucoside
  • papb-dg
CAS Number(s)
  • 20818-25-1
InChIKey MIAKOEWBCMPCQR-RMPHRYRLSA-N
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