1-Piperidinecarboxylic acid, 4-cyano-, ethyl ester


Chemical Name: 1-Piperidinecarboxylic acid, 4-cyano-, ethyl ester
CAS Number: 182808-28-2
Product Number: AG002452(AGN-PC-0L4MWB)
Synonyms:
MDL No:
Molecular Formula: C9H14N2O2
Molecular Weight: 182.2197

Identification/Properties


Computed Properties
Molecular Weight:
182.223g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
182.106g/mol
Monoisotopic Mass:
182.106g/mol
Topological Polar Surface Area:
53.3A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
223
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 4-cyanopiperidine-1-carboxylate is a versatile compound commonly employed in chemical synthesis for its significant role as a key building block in the creation of various organic molecules. This compound serves as a crucial intermediate in the synthesis of pharmaceutical agents, agrochemicals, and specialty chemicals due to its structural diversity and reactivity. Ethyl 4-cyanopiperidine-1-carboxylate enables the construction of complex molecular structures through functional group transformations and ring-closure reactions, providing a valuable tool for synthetic chemists in the design and development of structurally diverse compounds. Its applications extend to the preparation of heterocyclic compounds, natural product synthesis, and drug discovery research, highlighting its importance in the field of medicinal chemistry and organic synthesis.