1H-Purine, 6-iodo-


Chemical Name: 1H-Purine, 6-iodo-
CAS Number: 2545-26-8
Product Number: AG006UCW(AGN-PC-0O8AU4)
Synonyms:
MDL No:
Molecular Formula: C5H3IN4
Molecular Weight: 246.0086

Identification/Properties


Properties
BP:
490.4 °C at 760 mmHg
Storage:
Room Temperature;Light sensitive;Inert atmosphere;
Computed Properties
Molecular Weight:
246.011g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
245.94g/mol
Monoisotopic Mass:
245.94g/mol
Topological Polar Surface Area:
54.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
131
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



6-Iodo-9H-purine, also known as 6-iodopurine, is a versatile chemical compound that finds numerous applications in organic synthesis. One of the key uses of this compound is as a building block in the synthesis of various biologically active molecules and pharmaceuticals. Through its reactive iodine group, 6-Iodo-9H-purine can participate in a variety of substitution reactions, allowing for the introduction of new functional groups and modifications to the purine core structure. This flexibility makes it a valuable tool in the development of novel drug candidates and research compounds. Additionally, 6-Iodo-9H-purine can serve as a precursor in the preparation of fluorescent dyes, ligands for metal complexes, and other specialized chemicals. Its ability to undergo diverse chemical transformations makes it a valuable component in the toolkit of synthetic chemists working in medicinal chemistry, materials science, and other related fields.