3,4,6-Tri-O-Acetyl-2-Azido-2-Deoxy-α-D-Glucopyranosyl Chloride

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Properties Simple | Detailed

Formula C12H16ClN3O7
IUPAC Name [(2r,3s,4r,5r,6r)-3,4-diacetoxy-5-azido-6-chloro-tetrahydropyran-2-yl]methyl acetate
Molecular Mass 349.724 g·mol−1
Heat of Formation -1090.0 ± 16.7 kJ·mol−1
Dipole Moment 3.62 ± 1.08 D
Volume 372.87 Å 3
Surface Area 303.78 Å 2
HOMO Energy -9.86 ± 0.55 eV
LUMO Energy 2.96 ± eV
Point Group Symmetry C1
Synonyms
  • 1,3,4,6-tetra-o-acetyl-2-azido-2-deoxyglucopyranosylchloride
  • 3,4,6-tri-o-acetyl-2-azido-2-deoxyglucopyranosyl chloride
  • [(2r,3s,4r,5r,6r)-3,4-diacetoxy-5-azido-6-chloro-tetrahydropyran-2-yl]methyl acetate
  • [(2r,3s,4r,5r,6r)-3,4-diacetyloxy-5-azido-6-chloro-oxan-2-yl]methyl ethanoate
  • [(2r,3s,4r,5r,6r)-3,4-diacetyloxy-5-azido-6-chlorooxan-2-yl]methyl acetate
  • acetic acid [(2r,3s,4r,5r,6r)-3,4-diacetoxy-5-azido-6-chloro-2-tetrahydropyranyl]methyl ester
  • acetic acid [(2r,3s,4r,5r,6r)-3,4-diacetoxy-5-azido-6-chloro-tetrahydropyran-2-yl]methyl ester
  • alpha-d-glucopyranosyl chloride, 2-azido-2-deoxy-, 3,4,6-triacetate
  • taadc
CAS Number(s)
  • 67817-20-3
InChIKey DOGAQWBZVNXURX-OOCWMUITSA-N
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Elements H C N O Cl