2-Nitrophenyl 1-Thio-β-D-Galactopyranoside

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Formula C12H15NO7S
IUPAC Name (2r,3r,4s,5r,6s)-2-(hydroxymethyl)-6-(2-nitrophenyl)sulfanyl-tetrahydropyran-3,4,5-triol
Molecular Mass 317.315 g·mol−1
Heat of Formation -825.6 ± 16.7 kJ·mol−1
Dipole Moment 6.28 ± 1.08 D
Volume 336.84 Å 3
Surface Area 282.39 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy -1.35 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r,6s)-2-(hydroxymethyl)-6-(2-nitrophenyl)sulfanyl-oxane-3,4,5-triol
  • (2r,3r,4s,5r,6s)-2-(hydroxymethyl)-6-(2-nitrophenyl)sulfanyl-tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5r,6s)-2-(hydroxymethyl)-6-(2-nitrophenyl)sulfanyloxane-3,4,5-triol
  • (2r,3r,4s,5r,6s)-2-(hydroxymethyl)-6-[(2-nitrophenyl)thio]tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5r,6s)-2-methylol-6-[(2-nitrophenyl)thio]tetrahydropyran-3,4,5-triol
  • beta-d-galactopyranoside, 2-nitrophenyl 1-thio-
  • o-nitrophenol beta-thiogalactoside
  • o-nitrophenyl 1-thio-beta-d-galactopyranoside
CAS Number(s)
  • 1158-17-4
InChIKey SZAOZNVCHHBUDZ-RUXWNWLUSA-N
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