(4-Amino-2-Methyl-5-Pyrimidinyl)Methyl Trihydrogen Diphosphate

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Properties Simple | Detailed

Formula C6H11N3O7P2
IUPAC Name (4-amino-2-methyl-pyrimidin-5-yl)methyl phosphono hydrogen phosphate
Molecular Mass 299.115 g·mol−1
Heat of Formation -1797.1 ± 16.7 kJ·mol−1
Dipole Moment 4.95 ± 1.08 D
Volume 294.47 Å 3
Surface Area 273.92 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy -1.30 ± eV
Point Group Symmetry C1
Synonyms
  • (4-amino-2-methyl-5-pyrimidinyl)methyl phosphono hydrogen phosphate
  • (4-amino-2-methyl-pyrimidin-5-yl)methyl phosphono hydrogen phosphate
  • (4-amino-2-methylpyrimidin-5-yl)methyl diphosphate
  • (4-amino-2-methylpyrimidin-5-yl)methyl phosphono hydrogen phosphate
  • (4-amino-2-methylpyrimidin-5-yl)methyl trihydrogen diphosphate
  • 2-methyl-4-amino-5-hydroxymethylpyrimidine diphosphate
  • 4-amino-2-methyl-5-diphosphomethylpyrimidine
  • 4-amino-5-hydroxymethyl-2-methylpyrimidine-pp
  • 4-amino-5-hydroxymethyl-2-methylpyrimidine-pyrophosphate
  • hmp-pp
CAS Number(s)
  • 841-01-0
InChIKey AGQJQCFEPUVXNK-UHFFFAOYSA-N
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