3-(6-Amino-2-Oxo-1(2H)-Pyrimidinyl)Propanoic Acid

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Properties Simple | Detailed

Formula C7H9N3O3
IUPAC Name 3-(6-amino-2-oxo-pyrimidin-1-yl)propanoic acid
Molecular Mass 183.165 g·mol−1
Heat of Formation -457.5 ± 16.7 kJ·mol−1
Dipole Moment 7.42 ± 1.08 D
Volume 206.1 Å 3
Surface Area 200.43 Å 2
HOMO Energy -9.38 ± 0.55 eV
LUMO Energy -0.48 ± eV
Point Group Symmetry C1
Synonyms
  • 1(2h)-pyrimidinepropanoic acid, 3,6-dihydro-6-imino-2-oxo-
  • 3-(2-carboxyethyl)cytosine
  • 3-(6-amino-2-keto-pyrimidin-1-yl)propionic acid
  • 3-(6-amino-2-oxo-1-pyrimidinyl)propanoic acid
  • 3-(6-amino-2-oxopyrimidin-1-yl)propanoic acid
  • 3-cect
CAS Number(s)
  • 50615-41-3
InChIKey WYZGJTDHNAZBRC-UHFFFAOYSA-N
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