tert-butyl N-[(5-bromopyridin-3-yl)methyl]carbamate


Chemical Name: tert-butyl N-[(5-bromopyridin-3-yl)methyl]carbamate
CAS Number: 943722-24-5
Product Number: AG005XJK(AGN-PC-07XU8E)
Synonyms:
MDL No:
Molecular Formula: C11H15BrN2O2
Molecular Weight: 287.1530

Identification/Properties


Properties
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
287.157g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
286.032g/mol
Monoisotopic Mass:
286.032g/mol
Topological Polar Surface Area:
51.2A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
241
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

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NMR Spectrum


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Chemical Structure



The tert-Butyl (5-bromopyridin-3-yl)(methyl)carbamate is a versatile chemical compound that finds valuable applications in chemical synthesis processes. This compound serves as a key building block in organic synthesis, particularly in the development of pharmaceuticals, agrochemicals, and materials science.It is commonly used as a reagent in the creation of complex molecules due to its unique structural features and reactivity. The presence of the bromopyridine and carbamate moieties in the compound allows for a variety of functional group transformations, making it ideal for derivatization and modification of organic molecules.One significant application of tert-Butyl (5-bromopyridin-3-yl)(methyl)carbamate is in the synthesis of novel bioactive compounds, where it can serve as a key intermediate in the construction of pharmacologically active substances. Its selective reactivity towards specific functional groups enables chemists to introduce desired structural motifs efficiently, facilitating the creation of diverse chemical libraries for drug discovery purposes.Furthermore, this compound can also be utilized in the preparation of advanced materials with specific electronic or optical properties. By incorporating the tert-Butyl (5-bromopyridin-3-yl)(methyl)carbamate into the molecular structure of polymers or supramolecular assemblies, researchers can tailor the material properties for various technological applications.Overall, the tert-Butyl (5-bromopyridin-3-yl)(methyl)carbamate plays a crucial role in modern synthetic chemistry by enabling the efficient construction of complex and functionalized molecules with potential applications in drug development, materials science, and beyond.