4-Nitrophenyl 2-Acetamido-2-Deoxy-β-D-Galactopyranoside

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Properties Simple | Detailed

Formula C14H18N2O8
IUPAC Name n-[(2s,3r,4r,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)tetrahydropyran-3-yl]acetamide
Molecular Mass 342.301 g·mol−1
Heat of Formation -1045.5 ± 16.7 kJ·mol−1
Dipole Moment 8.01 ± 1.08 D
Volume 379.33 Å 3
Surface Area 331.72 Å 2
HOMO Energy -9.89 ± 0.55 eV
LUMO Energy 1.92 ± eV
Point Group Symmetry C1
Synonyms
  • 4-nitrophenyl n-acetyl-beta-d-galactosaminide
  • 4-nitrophenyl-2-acetamido-2-deoxygalactopyranoside
  • n-[(2s,3r,4r,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)-3-tetrahydropyranyl]acetamide
  • n-[(2s,3r,4r,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)oxan-3-yl]ethanamide
  • n-[(2s,3r,4r,5r,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-(4-nitrophenoxy)tetrahydropyran-3-yl]acetamide
  • n-[(2s,3r,4r,5r,6r)-4,5-dihydroxy-6-methylol-2-(4-nitrophenoxy)tetrahydropyran-3-yl]acetamide
  • p-nitrophenyl 2-acetamido-2-deoxy-beta-d-galactopyranoside
  • p-nitrophenyl n-acetyl-beta-d-galactosaminide
CAS Number(s)
  • 14948-96-0
InChIKey OMRLTNCLYHKQCK-RKQHYHRCSA-N
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