5-Hydroxy-3,4-Bis(Hydroxymethyl)-6-Methyl-2(1H)-Pyridinone

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Properties Simple | Detailed

Formula C8H11NO4
IUPAC Name 5-hydroxy-3,4-bis(hydroxymethyl)-6-methyl-1h-pyridin-2-one
Molecular Mass 185.177 g·mol−1
Heat of Formation -707.4 ± 16.7 kJ·mol−1
Dipole Moment 2.41 ± 1.08 D
Volume 208.04 Å 3
Surface Area 200.54 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy -0.87 ± eV
Point Group Symmetry C1
Synonyms
  • 2(1h)-pyridinone, 5-hydroxy-3,4-bis(hydroxymethyl)-6-methyl-
  • 5-hydroxy-3,4-bis(hydroxymethyl)-6-methyl-1h-pyridin-2-one
  • 5-hydroxy-6-methyl-3,4-dimethylol-2-pyridone
  • 6-hydroxypyridoxine
CAS Number(s)
  • 76963-36-5
InChIKey MDHSCVIVUKOXDV-UHFFFAOYSA-N
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