(2-Iminotetrahydropyrimidin-1(2H)-Yl)Acetic Acid

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Properties Simple | Detailed

Formula C6H11N3O2
IUPAC Name 2-(2-amino-5,6-dihydro-4h-pyrimidin-1-yl)acetic acid
Molecular Mass 157.170 g·mol−1
Heat of Formation -317.2 ± 16.7 kJ·mol−1
Dipole Moment 4.15 ± 1.08 D
Volume 184.26 Å 3
Surface Area 179.01 Å 2
HOMO Energy -8.95 ± 0.55 eV
LUMO Energy 3.26 ± eV
Point Group Symmetry C1
Synonyms
  • 1(2h)-pyrimidineacetic acid, tetrahydro-2-imino-
  • 1-carboxymethyl-2-iminohexahydropyrimidine
  • 1-carboxymethyl-ihhp
  • 2-(2-amino-5,6-dihydro-4h-pyrimidin-1-yl)acetic acid
  • 2-(2-amino-5,6-dihydro-4h-pyrimidin-1-yl)ethanoic acid
CAS Number(s)
  • 35404-56-9
InChIKey KDSBXFCETWZSBM-UHFFFAOYSA-N
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