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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)-

3-Pyridinecarboxylic acid, 6-nitro-, methyl ester

COC(=O)c1ccc(nc1)[N+](=O)[O-] Request for Quotation
Chemical Name: 3-Pyridinecarboxylic acid, 6-nitro-, methyl ester
CAS Number: 54973-78-3
Product Number: AG00DKYR(AGN-PC-041ATL)
Synonyms:
MDL No:
Molecular Formula: C7H6N2O4
Molecular Weight: 182.1335

Identification/Properties

Computed Properties
Molecular Weight:
182.135g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
182.033g/mol
Monoisotopic Mass:
182.033g/mol
Topological Polar Surface Area:
85A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
213
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#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


Methyl 6-nitronicotinate is a versatile intermediate commonly employed in chemical synthesis due to its unique properties and reactivity. In organic synthesis, this compound acts as a key starting material for the preparation of various aromatic compounds through nitration and subsequent functional group manipulations. Its nitro group serves as a valuable synthetic handle, allowing for further derivatization to access a wide range of structurally diverse molecules. Additionally, Methyl 6-nitronicotinate can participate in transition-metal-catalyzed cross-coupling reactions to facilitate the formation of carbon-carbon bonds, enabling the construction of complex organic frameworks. Furthermore, its presence in pharmaceutical research and development highlights its role in the synthesis of potential drug candidates and bioactive molecules. By harnessing the synthetic utility of Methyl 6-nitronicotinate, chemists can delve into the realm of molecular design and innovation to create novel compounds with diverse functionalities and applications in various fields of science and technology.