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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, 5-bromo-6-methoxy-, methyl ester

COC(=O)c1cnc(c(c1)Br)OC Request for Quotation
Chemical Name: 3-Pyridinecarboxylic acid, 5-bromo-6-methoxy-, methyl ester
CAS Number: 93349-99-6
Product Number: AG00H0JP(AGN-PC-07QVEC)
Synonyms:
MDL No:
Molecular Formula: C8H8BrNO3
Molecular Weight: 246.0580

Identification/Properties

Properties
BP:
275°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
246.06g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
244.969g/mol
Monoisotopic Mass:
244.969g/mol
Topological Polar Surface Area:
48.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
188
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 5-bromo-6-methoxynicotinate is a versatile compound that finds application in chemical synthesis as a key building block for the creation of various organic molecules. This compound serves as an important intermediate in the synthesis of potentially bioactive compounds and pharmaceuticals. With its unique structure, Methyl 5-bromo-6-methoxynicotinate can participate in a range of reactions to introduce functional groups or modify existing functionalities, making it a valuable tool in the development of new chemical entities. Its presence in the synthesis pathway allows for the efficient construction of complex molecular structures, highlighting its significance in the realm of organic chemistry.