3,4-Dinitrophenyl β-D-Galactopyranoside

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Formula C12H14N2O10
IUPAC Name (2s,3r,4s,5r,6r)-2-(3,4-dinitrophenoxy)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 346.247 g·mol−1
Heat of Formation -1012.6 ± 16.7 kJ·mol−1
Dipole Moment 7.50 ± 1.08 D
Volume 356.43 Å 3
Surface Area 305.07 Å 2
HOMO Energy -10.49 ± 0.55 eV
LUMO Energy -1.87 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r,4s,5r,6r)-2-(3,4-dinitrophenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
  • (2s,3r,4s,5r,6r)-2-(3,4-dinitrophenoxy)-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2s,3r,4s,5r,6r)-2-(3,4-dinitrophenoxy)-6-methylol-tetrahydropyran-3,4,5-triol
  • 3,4-dinitrophenyl-beta-galactopyranoside
  • 3,4-dnp-gal
CAS Number(s)
  • 85668-54-8
InChIKey AXPKTIFWSNCTCQ-YBXAARCKSA-N
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