(1R,2R,3R,7R,7Ar)-3-(Hydroxymethyl)Hexahydro-1H-Pyrrolizine-1,2,7-Triol

Molecule SVG Image

Properties Simple | Detailed

Formula C8H15NO4
IUPAC Name (1r,2r,3r,4s,7r,8r)-3-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1h-pyrrolizine-1,2,7-triol
Molecular Mass 189.209 g·mol−1
Heat of Formation -773.3 ± 16.7 kJ·mol−1
Dipole Moment 4.28 ± 1.08 D
Volume 220.57 Å 3
Surface Area 199.23 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy 1.75 ± eV
Point Group Symmetry C1
Synonyms
  • (1r,2r,3r,7r,8r)-3-(hydroxymethyl)-2,3,5,6,7,8-hexahydro-1h-pyrrolizine-1,2,7-triol
  • (1r,2r,3r,7r,8r)-3-methylolpyrrolizidine-1,2,7-triol
  • 1h-pyrrolizine-1,2,7-triol, hexahydro-2-(hydroxymethyl)-, (1r-(1alpha,2beta,3alpha,7beta,7aalpha))-
  • 1h-pyrrolizine-1,2,7-triol, hexahydro-3-(hydroxymethyl)-, (1r,2r,3r,7r,7ar)-
  • 3-(hydroxymethyl)-1,2,7-trihydroxypyrrolizidine
  • cast-3
InChIKey AIQMLBKBQCVDEY-FMDGEEDCSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N