4-Pyridinecarbonitrile, 2-formyl-


Chemical Name: 4-Pyridinecarbonitrile, 2-formyl-
CAS Number: 116308-38-4
Product Number: AG000C6F(AGN-PC-002GHC)
Synonyms:
MDL No:
Molecular Formula: C7H4N2O
Molecular Weight: 132.1195

Identification/Properties


Properties
BP:
201.0±20.0℃ (760 Torr)
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
132.122g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
132.032g/mol
Monoisotopic Mass:
132.032g/mol
Topological Polar Surface Area:
53.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
170
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

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NMR Spectrum


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Chemical Structure



2-Formylisonicotinonitrile (FIN) is a versatile compound widely employed in various chemical synthesis processes. As a key intermediate in organic chemistry, FIN serves as a crucial building block for the production of a diverse range of pharmaceuticals, agrochemicals, and fine chemicals. Its unique structure, characterized by a formyl group and a pyridine ring, enables multiple functionalization and reactivity pathways, making it an invaluable tool for synthetic chemists.In chemical synthesis, 2-Formylisonicotinonitrile plays a pivotal role in the construction of complex molecules through its ability to undergo a variety of transformation reactions. One of its primary applications lies in the formation of heterocyclic compounds, where its formyl group can participate in key bond-forming processes such as nucleophilic addition, acylation, and condensation reactions. This enables the synthesis of diverse heterocycles with important biological activities, including antimicrobial, antiviral, and anticancer properties.Furthermore, 2-Formylisonicotinonitrile can be utilized as a key precursor for the synthesis of pyridine derivatives, which are widely used in the pharmaceutical industry as drug candidates or intermediate compounds. Its reactivity towards amines, aldehydes, and ketones allows for the efficient construction of a variety of substituted pyridines, which are essential structural motifs in many bioactive molecules.Overall, the application of 2-Formylisonicotinonitrile in chemical synthesis offers a powerful strategy for accessing structurally diverse and biologically relevant compounds. Its versatility and reactivity make it an indispensable tool for the design and preparation of novel materials with potential applications in drug discovery, agriculture, and materials science.