ethyl 2-(1-benzyl-4-piperidylidene)-2-cyano-acetate


Chemical Name: ethyl 2-(1-benzyl-4-piperidylidene)-2-cyano-acetate
CAS Number: 1463-52-1
Product Number: AG001DVP(AGN-PC-0JR2MY)
Synonyms:
MDL No:
Molecular Formula: C17H20N2O2
Molecular Weight: 284.3529

Identification/Properties


Properties
MP:
64-67°C
BP:
430.4°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
284.359g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
284.152g/mol
Monoisotopic Mass:
284.152g/mol
Topological Polar Surface Area:
53.3A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
431
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



Ethyl 2-(1-Benzylpiperidin-4-ylidene)-2-cyanoacetate is a versatile compound used in chemical synthesis for various applications. This compound is commonly employed as a key intermediate in the production of pharmaceuticals, agrochemicals, and other fine chemicals. Its unique structure allows it to participate in a wide range of synthetic reactions, making it a valuable building block for the creation of complex organic molecules. In particular, Ethyl 2-(1-Benzylpiperidin-4-ylidene)-2-cyanoacetate is often utilized in the synthesis of bioactive compounds and drug candidates due to its potential for introducing specific functional groups and stereochemistry into target molecules. Its role in chemical synthesis extends to the creation of new materials and compounds with enhanced properties and diverse applications in various industries.