2-Deoxy-2-[(2-Methylbenzoyl)Amino]-α-D-Glucopyranose

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Properties Simple | Detailed

Formula C14H19NO6
IUPAC Name 2-methyl-n-[(2s,3r,4r,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]benzamide
Molecular Mass 297.304 g·mol−1
Heat of Formation -1069.8 ± 16.7 kJ·mol−1
Dipole Moment 2.24 ± 1.08 D
Volume 337.78 Å 3
Surface Area 299.86 Å 2
HOMO Energy -9.59 ± 0.55 eV
LUMO Energy -0.50 ± eV
Point Group Symmetry C1
Synonyms
  • 2-methyl-n-[(2s,3r,4r,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl]benzamide
  • 2-methyl-n-[(2s,3r,4r,5s,6r)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl]benzamide
  • 2-methyl-n-[(2s,3r,4r,5s,6r)-2,4,5-trihydroxy-6-methylol-tetrahydropyran-3-yl]benzamide
  • ortho-toluoylglucosamine
  • otg
InChIKey ZWRASUMSHKKCJN-SKENRDBWSA-N
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