4-Pyrimidinecarboxylic acid, 5-fluoro-1,2,3,6-tetrahydro-2,6-dioxo-


Chemical Name: 4-Pyrimidinecarboxylic acid, 5-fluoro-1,2,3,6-tetrahydro-2,6-dioxo-
CAS Number: 703-95-7
Product Number: AG003MRR(AGN-PC-0JL97J)
Synonyms:
MDL No:
Molecular Formula: C5H3FN2O4
Molecular Weight: 174.0867

Identification/Properties


Properties
MP:
278 °C (dec.);(lit.);
BP:
143°C (rough estimate)
Storage:
Keep in dry area;-10 ℃;
Form:
Solid
Solubility:
NH4OH 4 M: 50 mg/mL, clear, faintly yellow
Computed Properties
Molecular Weight:
174.087g/mol
XLogP3:
-0.9
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
174.008g/mol
Monoisotopic Mass:
174.008g/mol
Topological Polar Surface Area:
95.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
309
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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