(5-Hydroxy-6-Methyl-4-Vinyl-3-Pyridinyl)Methyl Dihydrogen Phosphate

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Properties Simple | Detailed

Formula C9H12NO5P
IUPAC Name (5-hydroxy-6-methyl-4-vinyl-3-pyridyl)methyl dihydrogen phosphate
Molecular Mass 245.169 g·mol−1
Heat of Formation -1056.0 ± 16.7 kJ·mol−1
Dipole Moment 2.38 ± 1.08 D
Volume 267.75 Å 3
Surface Area 249.67 Å 2
HOMO Energy -9.23 ± 0.55 eV
LUMO Energy -0.64 ± eV
Point Group Symmetry C1
Synonyms
  • (4-ethenyl-5-hydroxy-6-methyl-pyridin-3-yl)methyl dihydrogen phosphate
  • (4-ethenyl-5-hydroxy-6-methylpyridin-3-yl)methyl dihydrogen phosphate
  • 3-pyridinemethanol, 4-ethenyl-5-hydroxy-6-methyl-, alpha-(dihydrogen phosphate)
  • 4-vinylpyridoxal-5-phosphate
  • 4-vpdp
CAS Number(s)
  • 31383-64-9
InChIKey ITUIGLFMYPIKIU-UHFFFAOYSA-N
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