3-Pyridinecarboxylic acid, 5-(4-carboxyphenyl)-


Chemical Name: 3-Pyridinecarboxylic acid, 5-(4-carboxyphenyl)-
CAS Number: 597565-52-1
Product Number: AG00EKPL(AGN-PC-09Q3NQ)
Synonyms:
MDL No:
Molecular Formula: C13H9NO4
Molecular Weight: 243.2149

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
243.218g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
243.053g/mol
Monoisotopic Mass:
243.053g/mol
Topological Polar Surface Area:
87.5A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
323
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



5-(4-Carboxyphenyl)nicotinic acid is a versatile compound widely utilized in chemical synthesis for its unique properties. This compound serves as a key building block in the creation of various pharmaceuticals, agrochemicals, and materials due to its functional carboxylic acid group and aromatic structure. In organic synthesis, 5-(4-Carboxyphenyl)nicotinic acid can be used as a precursor in the synthesis of heterocyclic compounds and coordination complexes. Its presence allows for the introduction of the carboxylic acid functionality into target molecules, enabling further modifications or derivatizations to tailor the properties of the final product. Additionally, this compound can participate in cross-coupling reactions, condensations, and other transformations to yield structurally diverse chemical compounds with potentially valuable applications across different industries.