Octyl 3-Amino-3-Deoxy-β-D-Galactopyranoside

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Properties Simple | Detailed

Formula C14H29NO5
IUPAC Name (2r,3r,4s,5r,6r)-4-amino-2-(hydroxymethyl)-6-octoxy-tetrahydropyran-3,5-diol
Molecular Mass 291.384 g·mol−1
Heat of Formation -1084.3 ± 16.7 kJ·mol−1
Dipole Moment 3.89 ± 1.08 D
Volume 378.8 Å 3
Surface Area 349.95 Å 2
HOMO Energy -9.56 ± 0.55 eV
LUMO Energy 4.29 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r,6r)-4-amino-2-(hydroxymethyl)-6-octoxy-oxane-3,5-diol
  • (2r,3r,4s,5r,6r)-4-amino-2-(hydroxymethyl)-6-octoxy-tetrahydropyran-3,5-diol
  • (2r,3r,4s,5r,6r)-4-amino-2-(hydroxymethyl)-6-octoxyoxane-3,5-diol
  • (2r,3r,4s,5r,6r)-4-amino-2-(hydroxymethyl)-6-octoxytetrahydropyran-3,5-diol
  • (2r,3r,4s,5r,6r)-4-amino-2-methylol-6-octoxy-tetrahydropyran-3,5-diol
  • 4-amino-2-octyloxy-6-hydroxymethyl-tetrahydro-pyran-3,5-diol
  • aog
InChIKey HABUHWBZDNZBSI-MBJXGIAVSA-N
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