5-bromo-2-cyclopropylpyrimidine


Chemical Name: 5-bromo-2-cyclopropylpyrimidine
CAS Number: 304902-96-3
Product Number: AG0030C0(AGN-PC-02TNWW)
Synonyms:
MDL No:
Molecular Formula: C7H7BrN2
Molecular Weight: 199.0479

Identification/Properties


Properties
BP:
255℃
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
199.051g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
197.979g/mol
Monoisotopic Mass:
197.979g/mol
Topological Polar Surface Area:
25.8A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
117
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-H320-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



5-Bromo-2-cyclopropyl-pyrimidine is a valuable building block in chemical synthesis due to its versatile reactivity and unique structural properties. This compound serves as a key intermediate in the synthesis of various pharmaceuticals, agrochemicals, and functional materials. In organic chemistry, it can participate in various reactions such as nucleophilic substitutions, palladium-catalyzed cross-coupling reactions, and cycloadditions to afford structurally diverse molecules. Its cyclopropyl ring imparts rigidity and sterically demanding properties, making it a useful scaffold for designing bioactive compounds with improved potency and selectivity. Additionally, the bromine atom provides a handle for further functionalization, enabling the introduction of different substituents to tailor the compound's properties for specific applications. Overall, the strategic incorporation of 5-Bromo-2-cyclopropyl-pyrimidine in chemical synthesis facilitates the rapid and efficient construction of complex molecular architectures with potential biological or material relevance.