2-Acetylamino-2-Deoxy-B-D-Allopyranose

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Properties Simple | Detailed

Formula C8H15NO6
IUPAC Name n-[(2r,3r,4s,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
Molecular Mass 221.208 g·mol−1
Heat of Formation -1174.2 ± 16.7 kJ·mol−1
Dipole Moment 3.23 ± 1.08 D
Volume 244.14 Å 3
Surface Area 227.37 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy 0.78 ± eV
Point Group Symmetry C1
Synonyms
  • n-[(2r,3r,4s,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl]acetamide
  • n-[(2r,3r,4s,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamide
  • n-[(2r,3r,4s,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl]ethanamide
  • n-[(2r,3r,4s,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]acetamide
  • n-[(2r,3r,4s,5s,6r)-2,4,5-trihydroxy-6-methylol-tetrahydropyran-3-yl]acetamide
  • n-acetyl-d-allosamine
  • naa
InChIKey OVRNDRQMDRJTHS-UIAUGNHASA-N
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