2-Cyano-N-phenylacetamide


Chemical Name: 2-Cyano-N-phenylacetamide
CAS Number: 621-03-4
Product Number: AG00E9N9(AGN-PC-0WAMMF)
Synonyms:
MDL No: MFCD00019840
Molecular Formula: C9H8N2O
Molecular Weight: 160.1726

Identification/Properties


Properties
MP:
198-202 °C
BP:
401.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.5570 (estimate)
Computed Properties
Molecular Weight:
160.176g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
160.064g/mol
Monoisotopic Mass:
160.064g/mol
Topological Polar Surface Area:
52.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
198
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+H312+H332
Precautionary Statements:
P280
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Cyano-N-phenylacetamide, also known as CPA, is a versatile compound widely used in chemical synthesis for its diverse applications. As a key intermediate in organic chemistry, 2-Cyano-N-phenylacetamide plays a crucial role in the preparation of various pharmaceuticals, agrochemicals, and specialty chemicals.In chemical synthesis, 2-Cyano-N-phenylacetamide serves as a valuable building block for the construction of complex molecules. Its cyano group provides a reactive site for further functionalization, allowing for the introduction of different chemical moieties to tailor the properties of the final product. The presence of the phenylacetamide moiety contributes to the compound's structural diversity and compatibility with various synthetic routes.One of the key applications of 2-Cyano-N-phenylacetamide lies in the synthesis of pharmaceutical compounds. By incorporating this intermediate into drug development processes, chemists can access a wide range of pharmacological activities and enhance the efficacy of potential therapeutic agents. Additionally, the versatility of 2-Cyano-N-phenylacetamide enables the synthesis of bioactive compounds with specific pharmacokinetic profiles, making it a valuable tool in medicinal chemistry research.Furthermore, 2-Cyano-N-phenylacetamide is utilized in the production of agrochemicals, where its structural features can be leveraged to create crop protection products with targeted modes of action. By incorporating this compound into the design of herbicides, insecticides, and fungicides, researchers can enhance the selectivity and efficacy of agricultural chemicals, contributing to sustainable farming practices and crop yield improvement.Overall, the application of 2-Cyano-N-phenylacetamide in chemical synthesis encompasses a wide range of industries, from pharmaceuticals to agriculture, highlighting its significance as a versatile and indispensable intermediate in the creation of valuable chemical products.