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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

tert-butyl 3-(cyanomethyl)piperidine-1-carboxylate

N#CCC1CCCN(C1)C(=O)OC(C)(C)C Request for Quotation
Chemical Name: tert-butyl 3-(cyanomethyl)piperidine-1-carboxylate
CAS Number: 948015-72-3
Product Number: AG00IIJW(AGN-PC-0459I3)
Synonyms:
MDL No: MFCD08461079
Molecular Formula: C12H20N2O2
Molecular Weight: 224.2994

Identification/Properties

Computed Properties
Molecular Weight:
224.304g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
224.152g/mol
Monoisotopic Mass:
224.152g/mol
Topological Polar Surface Area:
53.3A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
298
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information

NMR Spectrum

Other Analytical Data

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Chemical Structure


The tert-Butyl 3-(cyanomethyl)piperidine-1-carboxylate is a versatile compound in chemical synthesis, frequently used as a building block in organic chemistry. Its unique structure and properties make it valuable for various reactions and transformations, particularly in the development of pharmaceuticals, agrochemicals, and fine chemicals. This compound serves as a crucial intermediate in the synthesis of various bioactive compounds due to its ability to participate in a wide range of organic reactions, including nucleophilic additions, cyclizations, and oxidations. In addition, the tert-Butyl 3-(cyanomethyl)piperidine-1-carboxylate can be modified and functionalized to introduce different functional groups, enabling the creation of diverse molecules with specific properties and activities. Its strategic use in chemical synthesis highlights its importance as a key component in the construction of complex molecules with potential applications in drug discovery and materials science.