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


Chemical Name: 4-Pyrimidinecarboxylic acid, 1,2,3,6-tetrahydro-5-nitro-2,6-dioxo-
CAS Number: 17687-24-0
Product Number: AG0024YW(AGN-PC-0JLDRW)
Synonyms:
MDL No:
Molecular Formula: C5H3N3O6
Molecular Weight: 201.0938

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
201.094g/mol
XLogP3:
-1.2
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
201.002g/mol
Monoisotopic Mass:
201.002g/mol
Topological Polar Surface Area:
141A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
377
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-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



5-Nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid is a valuable compound in chemical synthesis due to its versatile applications. This compound can serve as a key building block in the synthesis of various pharmaceuticals, agrochemicals, and specialty chemicals. It is commonly utilized as a precursor in the manufacturing of heterocyclic compounds, which are essential in drug discovery and development.Moreover, 5-Nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid is known for its reactivity in organic reactions, making it a valuable starting material for the introduction of functional groups or modifications in the molecular structure. Its unique chemical properties allow for the synthesis of complex organic molecules with specific biological or chemical activities.In addition, this compound can be employed in the preparation of intermediates for the synthesis of dyes, pigments, and polymers. Its presence in the chemical synthesis process contributes to the formation of diverse compounds with distinct properties and applications. Overall, 5-Nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylic acid plays a crucial role in the development of novel compounds with potential industrial and scientific significance.