N-(2,4-Diamino-6-Oxo-1,6-Dihydro-5-Pyrimidinyl)-N-Methylformamide

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Properties Simple | Detailed

Formula C6H9N5O2
IUPAC Name n-(2,6-diamino-4-oxo-1h-pyrimidin-5-yl)-n-methyl-formamide
Molecular Mass 183.168 g·mol−1
Heat of Formation -168.7 ± 16.7 kJ·mol−1
Dipole Moment 10.68 ± 1.08 D
Volume 205.15 Å 3
Surface Area 198.49 Å 2
HOMO Energy -9.17 ± 0.55 eV
LUMO Energy 2.66 ± eV
Point Group Symmetry C1
Synonyms
  • 2,6-diamino-4-hydroxy-5-(n-methyl)formamidopyrimidine
  • 2,6-diamino-4-hydroxy-5-n-methylformamidopyrimidine
  • formamide, n-(2,6-diamino-1,4-dihydro-4-oxo-5-pyrimidinyl)-n-methyl-
  • n(5)-methyl-n(5)-formyl-2,5,6-triamino-4-hydroxypyrimidine
  • n-(2,4-diamino-6-oxo-3h-pyrimidin-5-yl)-n-methyl-formamide
  • n-(2,4-diamino-6-oxo-3h-pyrimidin-5-yl)-n-methylformamide
CAS Number(s)
  • 77440-13-2
InChIKey CGWDNAFNQOBSCK-UHFFFAOYSA-N
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