2,2'-[(2,4,6-Trioxohexahydro-5-Pyrimidinyl)Imino]Diacetic Acid

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Properties Simple | Detailed

Formula C8H9N3O7
IUPAC Name 2-[carboxymethyl-(2,4,6-trioxohexahydropyrimidin-5-yl)amino]acetic acid
Molecular Mass 259.173 g·mol−1
Heat of Formation -1186.7 ± 16.7 kJ·mol−1
Dipole Moment 3.36 ± 1.08 D
Volume 268.18 Å 3
Surface Area 240.93 Å 2
HOMO Energy -10.31 ± 0.55 eV
LUMO Energy -0.97 ± eV
Point Group Symmetry C1
Synonyms
  • (hexahydro-2,4,6-trioxo-5-pyrimidinyl)iminodiacetic acid
  • 2-[carboxymethyl-(2,4,6-triketohexahydropyrimidin-5-yl)amino]acetic acid
  • 2-[carboxymethyl-(2,4,6-trioxo-1,3-diazinan-5-yl)amino]acetic acid
  • 2-[carboxymethyl-(2,4,6-trioxo-1,3-diazinan-5-yl)amino]ethanoic acid
  • 2-[carboxymethyl-(2,4,6-trioxo-5-hexahydropyrimidinyl)amino]acetic acid
  • acetic acid, ((hexahydro-2,4,6-trioxo-5-pyrimidinyl)imino)di-
  • acetic acid, [(hexahydro-2,4,6-trioxo-5-pyrimidinyl)imino]di-
  • glycine, n-(carboxymethyl)-n-(hexahydro-2,4,6-trioxo-5-pyrimidinyl)-
  • n-(carboxymethyl)-n-(hexahydro-2,4,6-trioxo-5-pyrimidinyl)glycine
  • uramil-n,n-diacetic acid
  • uramildiacetate acid
  • uramildiacetic acid
CAS Number(s)
  • 13055-06-6
  • 57603-24-4
  • 6243-00-1
InChIKey QDHGQJQZPJPKJK-UHFFFAOYSA-N
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