Heptyl α-D-Mannopyranoside

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Properties Simple | Detailed

Formula C13H26O6
IUPAC Name (2s,3s,4s,5s,6r)-2-heptoxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 278.342 g·mol−1
Heat of Formation -1282.7 ± 16.7 kJ·mol−1
Dipole Moment 2.56 ± 1.08 D
Volume 352.53 Å 3
Surface Area 321.91 Å 2
HOMO Energy -10.41 ± 0.55 eV
LUMO Energy 4.27 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s,4s,5s,6r)-2-heptoxy-6-(hydroxymethyl)oxane-3,4,5-triol
  • (2s,3s,4s,5s,6r)-2-heptoxy-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2s,3s,4s,5s,6r)-2-heptoxy-6-methylol-tetrahydropyran-3,4,5-triol
InChIKey NIDYWHLDTIVRJT-BNDIWNMDSA-N
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