(5R)-5-(Carboxymethyl)-α-D-Xylopyranose

Molecule SVG Image

Properties Simple | Detailed

Formula C7H12O7
IUPAC Name 2-[(2r,3s,4s,5r,6s)-3,4,5,6-tetrahydroxytetrahydropyran-2-yl]acetic acid
Molecular Mass 208.166 g·mol−1
Heat of Formation -1370.2 ± 16.7 kJ·mol−1
Dipole Moment 0.78 ± 1.08 D
Volume 221.94 Å 3
Surface Area 206.61 Å 2
HOMO Energy -10.56 ± 0.55 eV
LUMO Energy 0.49 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[(2r,3s,4s,5r,6s)-3,4,5,6-tetrahydroxy-2-tetrahydropyranyl]acetic acid
  • 2-[(2r,3s,4s,5r,6s)-3,4,5,6-tetrahydroxyoxan-2-yl]acetic acid
  • 2-[(2r,3s,4s,5r,6s)-3,4,5,6-tetrahydroxyoxan-2-yl]ethanoic acid
  • 2-[(2r,3s,4s,5r,6s)-3,4,5,6-tetrahydroxytetrahydropyran-2-yl]acetic acid
  • 6-deoxy-alpha-gluco-heptopyranosyluronic acid
  • 6-deoxy-alpha-gluco-pyranosiduronic acid
CAS Number(s)
  • 34980-72-8
InChIKey BZZCQGGHDQIPST-VCPFRWQBSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O