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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)-

4-Pyridinecarboxylic acid, 2-cyano-, ethyl ester

CCOC(=O)c1ccnc(c1)C#N Request for Quotation
Chemical Name: 4-Pyridinecarboxylic acid, 2-cyano-, ethyl ester
CAS Number: 58481-14-4
Product Number: AG00ED6N(AGN-PC-00MHEA)
Synonyms:
MDL No:
Molecular Formula: C9H8N2O2
Molecular Weight: 176.1720

Identification/Properties

Computed Properties
Molecular Weight:
176.175g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
176.059g/mol
Monoisotopic Mass:
176.059g/mol
Topological Polar Surface Area:
63A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
231
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


Ethyl 2-cyanoisonicotinate is a versatile chemical compound frequently employed in organic synthesis. This compound serves as a valuable building block for the construction of various biologically active molecules and pharmaceutical intermediates. Its unique structure and chemical properties make it an essential reagent in the preparation of diverse compounds through multistep synthetic routes. Due to its cyano and ester functional groups, Ethyl 2-cyanoisonicotinate participates in a range of reactions such as esterification, amidation, and nucleophilic addition, enabling the efficient formation of complex molecular structures. In chemical synthesis, this compound acts as a key component to introduce the 2-cyanoisonicotinate moiety into target molecules, facilitating the creation of novel compounds with potential applications in medicinal chemistry, agrochemicals, and materials science.