2-Phenylethyl 1-Thio-β-D-Galactopyranoside

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Formula C14H20O5S
IUPAC Name (2r,3r,4s,5r,6s)-2-(hydroxymethyl)-6-(2-phenylethylsulfanyl)tetrahydropyran-3,4,5-triol
Molecular Mass 300.371 g·mol−1
Heat of Formation -859.2 ± 16.7 kJ·mol−1
Dipole Moment 1.93 ± 1.08 D
Volume 348.47 Å 3
Surface Area 290.59 Å 2
HOMO Energy -8.91 ± 0.55 eV
LUMO Energy -0.62 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r,6s)-2-(hydroxymethyl)-6-(2-phenylethylsulfanyl)oxane-3,4,5-triol
  • (2r,3r,4s,5r,6s)-2-(hydroxymethyl)-6-(2-phenylethylsulfanyl)tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5r,6s)-2-(hydroxymethyl)-6-(2-phenylethylthio)tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5r,6s)-2-methylol-6-(2-phenylethylthio)tetrahydropyran-3,4,5-triol
  • 2-phenylethyl beta-d-thiogalactoside
  • ark072
  • phenethyl beta-d-thiogalactoside
InChIKey ZNAMMSOYKPMPGC-HTOAHKCRSA-N
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