1-(4-bromobenzoyl)piperidin-4-one


Chemical Name: 1-(4-bromobenzoyl)piperidin-4-one
CAS Number: 885274-92-0
Product Number: AG0046CH(AGN-PC-04PMXL)
Synonyms:
MDL No:
Molecular Formula: C12H12BrNO2
Molecular Weight: 282.1332

Identification/Properties


Properties
Storage:
Keep in dry area;Room Temperature;
Computed Properties
Molecular Weight:
282.137g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
281.005g/mol
Monoisotopic Mass:
281.005g/mol
Topological Polar Surface Area:
37.4A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
275
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



1-(4-Bromobenzoyl)piperidin-4-one is a versatile compound commonly used in chemical synthesis for its unique properties. In organic synthesis, this compound serves as a key building block in the development of various pharmaceuticals, agrochemicals, and material science applications. Its structural features make it a valuable intermediate in the preparation of diverse organic molecules through multi-step synthetic routes. Additionally, 1-(4-Bromobenzoyl)piperidin-4-one is often utilized as a precursor in the creation of complex organic frameworks with specific biological activities, making it an essential component in drug discovery and development processes. Its ability to undergo various functional group transformations allows for the creation of novel molecular structures with tailored properties, enabling researchers to explore new chemical space and potentially discover valuable compounds with enhanced biological or material properties.