3-Nitrophenyl α-D-Galactopyranoside

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Properties Simple | Detailed

Formula C12H15NO8
IUPAC Name (2r,3r,4s,5r,6r)-2-(hydroxymethyl)-6-(3-nitrophenoxy)tetrahydropyran-3,4,5-triol
Molecular Mass 301.249 g·mol−1
Heat of Formation -1033.2 ± 16.7 kJ·mol−1
Dipole Moment 4.40 ± 1.08 D
Volume 322.41 Å 3
Surface Area 280.69 Å 2
HOMO Energy -10.11 ± 0.55 eV
LUMO Energy 1.53 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,3r,4s,5r,6r)-2-(hydroxymethyl)-6-(3-nitrophenoxy)tetrahydropyran-3,4,5-triol
  • (2r,3r,4s,5r,6r)-2-methylol-6-(3-nitrophenoxy)tetrahydropyran-3,4,5-triol
  • gaa
  • metanitrophenyl-alpha-d-galactoside
InChIKey VCCMGHVCRFMITI-IIRVCBMXSA-N
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