N-(Dimethoxyphosphoryl)-β-D-Glucopyranosylamine

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Properties Simple | Detailed

Formula C8H18NO8P
IUPAC Name (2r,3r,4s,5s,6r)-2-(dimethoxyphosphorylamino)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 287.204 g·mol−1
Heat of Formation -1706.8 ± 16.7 kJ·mol−1
Dipole Moment 3.04 ± 1.08 D
Volume 310.48 Å 3
Surface Area 267.03 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5s,6r)-2-(dimethoxyphosphorylamino)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5s,6r)-2-(dimethoxyphosphorylamino)-6-methylol-tetrahydropyran-3,4,5-triol
  • (3,4,5-trihydroxy-6-hydroxymethyl-tetrahydro-pyran-2-yl)-phosphoramidic acid dimethyl ester
  • gl6
InChIKey LJBUJRWZZYUNKX-JAJWTYFOSA-N
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