2-Chloroethyl β-D-Fructopyranoside

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Properties Simple | Detailed

Formula C8H15ClO6
IUPAC Name (2s,3s,4r,5r)-2-(2-chloroethoxy)-2-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 242.654 g·mol−1
Heat of Formation -1198.5 ± 16.7 kJ·mol−1
Dipole Moment 4.55 ± 1.08 D
Volume 256.62 Å 3
Surface Area 223.82 Å 2
HOMO Energy -10.33 ± 0.55 eV
LUMO Energy 0.44 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3s,4r,5r)-2-(2-chloroethoxy)-2-(hydroxymethyl)oxane-3,4,5-triol
  • (2s,3s,4r,5r)-2-(2-chloroethoxy)-2-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2s,3s,4r,5r)-2-(2-chloroethoxy)-2-methylol-tetrahydropyran-3,4,5-triol
InChIKey UNKSWTOXDXZLNE-OOJXKGFFSA-N
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Elements H C O Cl