4-Nitrophenyl 2-Deoxy-2-[(Methylsulfonyl)Amino]-β-D-Glucopyranoside

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Properties Simple | Detailed

Formula C13H18N2O9S
IUPAC Name n-[(2s,3r,4r,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)tetrahydropyran-3-yl]methanesulfonamide
Molecular Mass 378.355 g·mol−1
Heat of Formation -1171.1 ± 16.7 kJ·mol−1
Dipole Moment 9.61 ± 1.08 D
Volume 398.98 Å 3
Surface Area 344.76 Å 2
HOMO Energy -9.99 ± 0.55 eV
LUMO Energy 1.86 ± eV
Point Group Symmetry C1
Synonyms
  • 4-nitrophenyl-2-methanesulfonamide 2-deoxy-beta-d-glucopyranoside
  • beta-d-glucopyranoside, 4-nitrophenyl 2-deoxy-2-((methylsulfonyl)amino)-
  • n-[(2s,3r,4r,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)-3-tetrahydropyranyl]methanesulfonamide
  • n-[(2s,3r,4r,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]methanesulfonamide
  • n-[(2s,3r,4r,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)tetrahydropyran-3-yl]methanesulfonamide
  • n-[(2s,3r,4r,5s,6r)-4,5-dihydroxy-6-methylol-2-(4-nitrophenoxy)tetrahydropyran-3-yl]methanesulfonamide
  • p-nitrophenyl n-methanesulfony beta-d-glucosaminide
  • p-nitrophenyl-2-methanesulfonamide 2-deoxy-beta-d-glucopyranoside
CAS Number(s)
  • 52207-06-4
InChIKey RZDJXHWEZNGEOW-SYLRKERUSA-N
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