5-Chloro-2,6-Dioxo-1,2,3,6-Tetrahydro-4-Pyrimidinecarboxylic Acid

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Properties Simple | Detailed

Formula C5H3ClN2O4
IUPAC Name 5-chloro-2,4-dioxo-1h-pyrimidine-6-carboxylic acid
Molecular Mass 190.541 g·mol−1
Heat of Formation -668.0 ± 16.7 kJ·mol−1
Dipole Moment 2.77 ± 1.08 D
Volume 175.67 Å 3
Surface Area 176.53 Å 2
HOMO Energy -10.04 ± 0.55 eV
LUMO Energy 1.12 ± eV
Point Group Symmetry Cs
Synonyms
  • 5-chloro-2,6-diketo-3h-pyrimidine-4-carboxylic acid
  • 5-chloro-2,6-dioxo-3h-pyrimidine-4-carboxylic acid
CAS Number(s)
  • 36313-98-1
InChIKey AJYLJEAORVKEHN-UHFFFAOYSA-N
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Elements H C N O Cl