1,3,4,6-Tetra-O-Acetyl-α-D-Fructofuranosyl 2-O-Acetyl-α-D-Glucopyranoside

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Properties Simple | Detailed

Formula C20H18O16
IUPAC Name ethanol; formaldehyde; 3,6,7,9-tetrakis(oxomethylene)-2,5,8,10,12-pentaoxabicyclo[9.4.0]pentadec-1(11)-ene-14,15-dione
Molecular Mass 514.347 g·mol−1
Heat of Formation -3070.0 ± 16.7 kJ·mol−1
Dipole Moment 4.72 ± 1.08 D
Volume 613.98 Å 3
Surface Area 451.15 Å 2
HOMO Energy -10.04 ± 0.55 eV
LUMO Energy 0.37 ± eV
Point Group Symmetry C1
Synonyms
  • 2,1',3',4',6'-penta-o-acetylsucrose
  • 5ac-sucrose
  • [(2r,3s,4r,5r)-4-acetoxy-2-[(2r,3r,4s,5s,6r)-3-acetoxy-4,5-dihydroxy-6-(hydroxymethyl)tetrahydropyran-2-yl]oxy-2,5-bis(acetoxymethyl)tetrahydrofuran-3-yl] acetate
  • [(2r,3s,4r,5r)-4-acetyloxy-2-[(2r,3r,4s,5s,6r)-3-acetyloxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,5-bis(acetyloxymethyl)oxolan-3-yl] acetate
  • [(2r,3s,4r,5r)-4-acetyloxy-2-[(2r,3r,4s,5s,6r)-3-acetyloxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,5-bis(acetyloxymethyl)oxolan-3-yl] ethanoate
  • acetic acid [(2r,3s,4r,5r)-4-acetoxy-2-[(2r,3r,4s,5s,6r)-3-acetoxy-4,5-dihydroxy-6-methylol-tetrahydropyran-2-yl]oxy-2,5-bis(acetoxymethyl)tetrahydrofuran-3-yl] ester
  • acetic acid [(2r,3s,4r,5r)-4-acetoxy-2-[[(2r,3r,4s,5s,6r)-3-acetoxy-4,5-dihydroxy-6-(hydroxymethyl)-2-tetrahydropyranyl]oxy]-2,5-bis(acetoxymethyl)-3-tetrahydrofuranyl] ester
CAS Number(s)
  • 149057-51-2
InChIKey XCWXTSUUVWUERP-TXMBSKIZSA-N
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