1-[3-(Aminooxy)-3-Oxopropyl]-2,4(1H,3H)-Pyrimidinedione

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Properties Simple | Detailed

Formula C7H10N3O4+++
IUPAC Name amino 3-(2,4-dioxopyrimidin-1-yl)propanoate
Molecular Mass 200.172 g·mol−1
Heat of Formation -546.0 ± 16.7 kJ·mol−1
Dipole Moment 3.79 ± 1.08 D
Volume 218.93 Å 3
Surface Area 215.86 Å 2
HOMO Energy -10.01 ± 0.55 eV
LUMO Energy 2.24 ± eV
Point Group Symmetry C1
Synonyms
  • (s)-alpha-amino-3,4-dihydro-2,4-dioxo-1(2h)-pyrimidine propanoic acid
  • 3-(2,4-diketopyrimidin-1-yl)propionic acid amino ester
  • 3-(2,4-dioxo-1-pyrimidinyl)propanoic acid amino ester
  • beta-(2,4-dihydroxypyrimidin-1-yl)alanine
InChIKey KCGPSMHZJWSWPT-UHFFFAOYSA-N
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