5-Fluoroorotic Acid

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Properties Simple | Detailed

Formula C5H3FN2O4++
IUPAC Name 5-fluoro-2,6-dioxo-pyrimidine-4-carboxylic acid
Molecular Mass 174.087 g·mol−1
Heat of Formation -816.0 ± 16.7 kJ·mol−1
Dipole Moment 3.60 ± 1.08 D
Volume 164.24 Å 3
Surface Area 168.27 Å 2
HOMO Energy -10.34 ± 0.55 eV
LUMO Energy -1.82 ± eV
Point Group Symmetry Cs
Synonyms
  • 1,2,3,6-tetrahydro-2,6-dioxo-5-fluoro-4-pyrimidinecarboxylic acid
  • 4-pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-2,6-dioxo-5-fluoro-
  • 4-pyrimidinecarboxylic acid, 5-fluoro-1,2,3,6-tetrahydro-2,6-dioxo-
  • 4-pyrimidinecarboxylic acid, 5-fluoro-1,2,3,6-tetrahydro-2,6-dioxo- (9ci)
  • 4-pyrimidinecarboxylic acid, 5-fluoro-1,2,3,6-tetrahydro-2,6-dioxo-, monohydrate
  • 5-fluoro-2,6-diketo-3h-pyrimidine-4-carboxylic acid
  • 5-fluoro-2,6-dioxo-3h-pyrimidine-4-carboxylic acid
  • 5-fluoroorotate
  • 5-fluoroorotic acid (van)
  • ent-26398
  • fluoroorotic acid
  • fo
  • fot
  • orotic acid, 5-fluoro-
  • orotic acid, 5-fluoro- (van) (8ci)
  • p-1311
  • ro 2-9945
  • wr 152520
CAS Number(s)
  • 703-95-7
InChIKey SEHFUALWMUWDKS-UHFFFAOYSA-N
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