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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)-

2-Pyridinecarbonitrile, 5-(bromomethyl)-

BrCc1ccc(nc1)C#N Request for Quotation
Chemical Name: 2-Pyridinecarbonitrile, 5-(bromomethyl)-
CAS Number: 308846-06-2
Product Number: AG0031KA(AGN-PC-03HU1E)
Synonyms:
MDL No:
Molecular Formula: C7H5BrN2
Molecular Weight: 197.0320

Identification/Properties

Computed Properties
Molecular Weight:
197.035g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
195.964g/mol
Monoisotopic Mass:
195.964g/mol
Topological Polar Surface Area:
36.7A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
149
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:
P280-P305+P351+P338-P310
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


5-(Bromomethyl)picolinonitrile is a versatile chemical compound that finds wide application in the field of chemical synthesis. This compound acts as a valuable building block in the creation of various complex organic molecules. Its unique molecular structure, containing both a nitrile group and a bromomethyl moiety, allows for diverse reactivity and functionalization possibilities.One prominent application of 5-(Bromomethyl)picolinonitrile is in the synthesis of pharmaceutical compounds. The bromomethyl group serves as a key site for further functionalization, enabling the introduction of specific chemical groups necessary for producing bioactive molecules. Additionally, the nitrile group in the compound can undergo various transformations to generate new chemical entities with desired properties.In organic synthesis, 5-(Bromomethyl)picolinonitrile is frequently employed in the construction of heterocyclic structures, such as pyridine derivatives. By engaging in cross-coupling reactions or nucleophilic substitutions, this compound contributes to the formation of complex organic frameworks essential for drug discovery and material science.Furthermore, the presence of the bromine atom in 5-(Bromomethyl)picolinonitrile enhances its reactivity in transition-metal-catalyzed transformations. This reactivity profile opens up avenues for the development of innovative synthetic routes and the rapid assembly of molecular scaffolds with high structural diversity.Overall, 5-(Bromomethyl)picolinonitrile stands as a valuable synthetic intermediate with versatile applications in chemical synthesis, particularly in the creation of pharmaceuticals and complex organic molecules. Its strategic placement of functional groups and reactivity characteristics make it a prized component in the toolkit of synthetic chemists seeking to access novel compounds with tailored properties.