Phenol, 4-bromo-2-iodo-


Chemical Name: Phenol, 4-bromo-2-iodo-
CAS Number: 207115-22-8
Product Number: AG002IU6(AGN-PC-0NCWVE)
Synonyms:
MDL No:
Molecular Formula: C6H4BrIO
Molecular Weight: 298.9038

Identification/Properties


Properties
MP:
90℃ (ethanol )
BP:
243°C at 760 mmHg
Storage:
2-8℃;Light sensitive;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
298.905g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
297.849g/mol
Monoisotopic Mass:
297.849g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
99.1
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


Other Analytical Data


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Chemical Structure



2-Iodo-4-bromophenol is a valuable chemical compound widely used in chemical synthesis procedures. Its unique properties make it a versatile building block in various organic reactions, particularly in the field of medicinal chemistry and agrochemical research. This compound serves as a key intermediate in the synthesis of pharmaceutical drugs, biologically active molecules, and specialty chemicals.In organic synthesis, 2-Iodo-4-bromophenol acts as a nucleophilic substitution reagent, enabling the introduction of iodine and bromine atoms at specific positions in target molecules. This can lead to the creation of novel structures with enhanced biological activity or improved chemical properties. Additionally, its phenolic moiety can participate in various coupling reactions, such as Suzuki-Miyaura cross-coupling, to form complex molecular frameworks.Furthermore, 2-Iodo-4-bromophenol is utilized in the preparation of ligands for transition metal catalysis, where its dual halogen functionality can facilitate coordination with metal centers. This can be crucial in the design of efficient catalyst systems for asymmetric transformations and other synthetic applications.Overall, the strategic incorporation of 2-Iodo-4-bromophenol in chemical synthesis offers opportunities for the development of diverse compounds with potential therapeutic, agricultural, or industrial significance. Its versatility and reactivity make it a valuable tool for organic chemists seeking to explore new pathways and discover innovative molecules.