Methyl β-D-Galactopyranuronate

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Properties Simple | Detailed

Formula C7H12O7
IUPAC Name methyl (2s,3r,4s,5r,6r)-3,4,5,6-tetrahydroxytetrahydropyran-2-carboxylate
Molecular Mass 208.166 g·mol−1
Heat of Formation -1306.4 ± 16.7 kJ·mol−1
Dipole Moment 2.11 ± 1.08 D
Volume 218.49 Å 3
Surface Area 203.73 Å 2
HOMO Energy -10.43 ± 0.55 eV
LUMO Energy 3.54 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r,4s,5r,6r)-3,4,5,6-tetrahydroxy-2-tetrahydropyrancarboxylic acid methyl ester
  • (2s,3r,4s,5r,6r)-3,4,5,6-tetrahydroxytetrahydropyran-2-carboxylic acid methyl ester
  • methyl (2s,3r,4s,5r,6r)-3,4,5,6-tetrahydroxyoxane-2-carboxylate
  • methyl (2s,3r,4s,5r,6r)-3,4,5,6-tetrahydroxytetrahydropyran-2-carboxylate
InChIKey DICCNWCUKCYGNF-SXUWKVJYSA-N
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