4-bromo-2-(chloromethyl)-1-iodobenzene


Chemical Name: 4-bromo-2-(chloromethyl)-1-iodobenzene
CAS Number: 1261817-10-0
Product Number: AG000S0Z(AGN-PC-0J0Q2O)
Synonyms:
MDL No:
Molecular Formula: C7H5BrClI
Molecular Weight: 331.3761

Identification/Properties


Computed Properties
Molecular Weight:
331.375g/mol
XLogP3:
3.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
0
Rotatable Bond Count:
1
Exact Mass:
329.831g/mol
Monoisotopic Mass:
329.831g/mol
Topological Polar Surface Area:
0A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
110
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:
Danger
UN#:
1760
Hazard Statements:
H302-H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Iodo-5-bromobenzyl chloride is a versatile chemical reagent commonly used in chemical synthesis processes. With its unique structure and reactive properties, it serves as a valuable building block for creating a wide range of complex organic compounds.One of the key applications of 2-Iodo-5-bromobenzyl chloride in chemical synthesis is in the field of medicinal chemistry. Its ability to undergo various substitution reactions makes it a valuable precursor for the synthesis of pharmaceutical intermediates and potential drug candidates. By strategically incorporating this compound into chemical reactions, researchers can modify its structure to introduce specific functional groups or stereochemical elements, ultimately leading to the development of novel drug molecules with potentially enhanced therapeutic properties.Furthermore, 2-Iodo-5-bromobenzyl chloride can also be employed in the synthesis of biologically active compounds, agrochemicals, and specialty chemicals. Its reactive nature allows for the selective introduction of halogen atoms and other substituents at specific positions on the benzyl ring, enabling the fine-tuning of molecular structures to achieve desired properties or activities.In summary, the strategic use of 2-Iodo-5-bromobenzyl chloride in chemical synthesis offers a powerful tool for synthetic chemists to access diverse chemical space and create valuable compounds with applications across various industries.