Ethanone, 1-(4-bromo-3-chlorophenyl)-


Chemical Name: Ethanone, 1-(4-bromo-3-chlorophenyl)-
CAS Number: 3114-31-6
Product Number: AG00BG4E(AGN-PC-03OMMM)
Synonyms:
MDL No:
Molecular Formula: C8H6BrClO
Molecular Weight: 233.4896

Identification/Properties


Properties
BP:
310°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
233.489g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
1
Exact Mass:
231.929g/mol
Monoisotopic Mass:
231.929g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
160
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:
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



4'-Bromo-3'-chloroacetophenone is a valuable chemical compound widely used in organic synthesis processes. This compound is particularly useful in the production of pharmaceuticals, agrochemicals, and various other fine chemicals. Its unique combination of bromine and chlorine atoms makes it a versatile building block in the creation of more complex molecules.One key application of 4'-Bromo-3'-chloroacetophenone in chemical synthesis is its role as a reactive intermediate in the preparation of a variety of heterocyclic compounds. By taking advantage of the reactivity of the bromine and chlorine atoms, chemists are able to introduce specific functional groups at precise locations in a molecule, enabling the synthesis of diverse chemical structures.Furthermore, this compound serves as a key starting material for the synthesis of biologically active molecules, making it a crucial component in drug discovery and development. Its ability to undergo various substitution reactions allows for the creation of new and potent pharmaceutical agents with specific biological activities.In summary, 4'-Bromo-3'-chloroacetophenone plays a vital role in chemical synthesis by offering chemists a versatile tool for creating complex molecules with tailored properties for a wide range of applications.