5-Bromo-1H-Indol-3-Yl β-D-Galactopyranoside

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Properties Simple | Detailed

Formula C14H16BrNO6
IUPAC Name (2s,3r,4s,5r,6r)-2-[(5-bromo-1h-indol-3-yl)oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
Molecular Mass 374.184 g·mol−1
Heat of Formation -870.3 ± 16.7 kJ·mol−1
Dipole Moment 3.90 ± 1.08 D
Volume 356.88 Å 3
Surface Area 318.16 Å 2
HOMO Energy -8.60 ± 0.55 eV
LUMO Energy -0.54 ± eV
Point Group Symmetry C1
Synonyms
  • (2s,3r,4s,5r,6r)-2-[(5-bromo-1h-indol-3-yl)oxy]-6-(hydroxymethyl)tetrahydropyran-3,4,5-triol
  • (2s,3r,4s,5r,6r)-2-[(5-bromo-1h-indol-3-yl)oxy]-6-methylol-tetrahydropyran-3,4,5-triol
  • 5-brig
  • 5-bromo-3-indolyl beta-d-galactopyranoside
  • 5-bromo-3-indolyl-beta-galactoside
  • beta-d-galactopyranoside, 5-bromo-1h-indol-3-yl
  • bluo-gal
CAS Number(s)
  • 97753-82-7
InChIKey LINMATFDVHBYOS-MBJXGIAVSA-N
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Elements H C O Br N