2-Acetyl-3-[(4-Amino-2-Methyl-5-Pyrimidinyl)Methyl]-5-(2-{[Hydroxy(Phosphonooxy)Phosphoryl]Oxy}Ethyl)-4-Methyl-1,3-Thiazol-3-Ium

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Properties Simple | Detailed

Formula C14H24N4O8P2S
IUPAC Name 2-[2-acetyl-3-[(4-amino-2-methylpyrimidin-5-yl)methyl]-4-methyl-1,3-thiazol-3-ium-5-yl]ethyl phosphono hydrogen phosphate
Molecular Mass 470.375 g·mol−1
Heat of Formation -1938.9 ± 16.7 kJ·mol−1
Dipole Moment 6.52 ± 1.08 D
Volume 483.16 Å 3
Surface Area 377.63 Å 2
Point Group Symmetry C1
Synonyms
  • 2-acetyl-3-[(4-amino-2-methyl-5-pyrimidinyl)methyl]-4-methyl-5-(4,6,6-trihydroxy-3,5-dioxa-4,6-diphosphahex-1-yl)thiazolium inner salt p,p'-dioxide
  • 2-acetyl-thiamine diphosphate
InChIKey GYRGKLZCJRVYRV-UHFFFAOYSA-O
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