1,2-Anhydro-6-Bromo-6-Deoxygalactitol

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Properties Simple | Detailed

Formula C6H11BrO4
IUPAC Name (1s,2r,3s)-4-bromo-1-[(2s)-oxiran-2-yl]butane-1,2,3-triol
Molecular Mass 227.053 g·mol−1
Heat of Formation -648.9 ± 16.7 kJ·mol−1
Dipole Moment 0.36 ± 1.08 D
Volume 208.49 Å 3
Surface Area 199.64 Å 2
HOMO Energy -10.42 ± 0.55 eV
LUMO Energy 0.19 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,2r,3s)-4-bromo-1-[(2s)-2-oxiranyl]butane-1,2,3-triol
  • (1s,2r,3s)-4-bromo-1-[(2s)-oxiran-2-yl]butane-1,2,3-triol
  • 1,2-anhydro-6-brom-6-deoxydulcitol
  • 1,2-anhydro-6-bromogalactitol
  • 5,6-anhydro-1-bromo-1-deoxygalactitol
  • 5,6-anhydro-1-bromo-1-deoxyglactitol
  • brepg
  • galactitol, 5,6-anhydro-1-bromo-1-deoxy-
CAS Number(s)
  • 70791-26-3
  • 84798-55-0
InChIKey TTXMHDKJKIQMDJ-DPYQTVNSSA-N
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Elements H C O Br