Methyl 4-Thio-α-D-Glucopyranoside

Molecule SVG Image

Properties Simple | Detailed

Formula C7H14O5S
IUPAC Name (2s,3r,4r,5s,6r)-6-(hydroxymethyl)-2-methoxy-5-sulfanyl-tetrahydropyran-3,4-diol
Molecular Mass 210.248 g·mol−1
Heat of Formation -947.4 ± 16.7 kJ·mol−1
Dipole Moment 3.09 ± 1.08 D
Volume 236.63 Å 3
Surface Area 214.66 Å 2
HOMO Energy -9.00 ± 0.55 eV
LUMO Energy 2.54 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r,4r,5s,6r)-5-mercapto-2-methoxy-6-methylol-tetrahydropyran-3,4-diol
  • (2s,3r,4r,5s,6r)-6-(hydroxymethyl)-2-methoxy-5-sulfanyl-oxane-3,4-diol
  • (2s,3r,4r,5s,6r)-6-(hydroxymethyl)-2-methoxy-5-sulfanyl-tetrahydropyran-3,4-diol
  • (2s,3r,4r,5s,6r)-6-(hydroxymethyl)-5-mercapto-2-methoxytetrahydropyran-3,4-diol
  • ma3
  • o1-methyl-4-deoxy-4-thio-alpha-d-glucose
InChIKey PFROTWRHYMLGHR-GKHCUFPYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O