(4-Formyl-5-Hydroxy-6-Methyl-1-Oxido-3-Pyridinyl)Methyl Dihydrogen Phosphate

Molecule SVG Image

Properties Simple | Detailed

Formula C8H18NO7P+
IUPAC Name 3-hydroxy-2-methyl-1-oxido-piperidine-2,3,4,5,6-pentaide-4-carbaldehyde; methanidyl hydrogen phosphate
Molecular Mass 271.205 g·mol−1
Heat of Formation -1227.3 ± 16.7 kJ·mol−1
Dipole Moment 3.30 ± 1.08 D
Volume 275.71 Å 3
Surface Area 237.34 Å 2
HOMO Energy -9.32 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry C1
Synonyms
  • (4-formyl-5-hydroxy-6-methyl-1-oxido-3-pyridin-1-iumyl)methyl dihydrogen phosphate
  • (4-formyl-5-hydroxy-6-methyl-1-oxido-pyridin-1-ium-3-yl)methyl dihydrogen phosphate
  • (5-hydroxy-4-methanoyl-6-methyl-1-oxido-pyridin-1-ium-3-yl)methyl dihydrogen phosphate
  • [hydroxy-(5-hydroxy-4,6-dimethyl-1-oxidopyridin-1-ium-3-yl)methyl] dihydrogen phosphate
InChIKey BBWRYPTUKZTWFD-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements P C H O N