4-fluoro-3-iodo-1-methylindazole


Chemical Name: 4-fluoro-3-iodo-1-methylindazole
CAS Number: 1257535-07-1
Product Number: AG009Z68(AGN-PC-093FL4)
Synonyms:
MDL No:
Molecular Formula: C8H6FIN2
Molecular Weight: 276.0495132

Identification/Properties


Computed Properties
Molecular Weight:
276.053g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
275.956g/mol
Monoisotopic Mass:
275.956g/mol
Topological Polar Surface Area:
17.8A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
178
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


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Chemical Structure



4-Fluoro-3-iodo-1-methyl-1H-indazole is a versatile compound that finds significant application in chemical synthesis. This compound serves as a valuable building block in the creation of various pharmaceuticals, agrochemicals, and materials due to its unique structural properties.Due to the presence of both fluorine and iodine atoms in its structure, 4-Fluoro-3-iodo-1-methyl-1H-indazole can participate in a wide range of chemical reactions, allowing for the introduction of specific functional groups in target molecules. This flexibility makes it a valuable tool for organic chemists looking to synthesize complex molecules efficiently.In pharmaceutical chemistry, this compound can be utilized in the construction of drug candidates or intermediates, where the precise placement of functional groups is crucial for optimizing biological activity and pharmacokinetic properties. Its ability to serve as a halogenated heterocycle also makes it an attractive candidate for the development of new drug leads with enhanced potency and selectivity.Furthermore, in agrochemical synthesis, 4-Fluoro-3-iodo-1-methyl-1H-indazole can be employed to design novel pesticides or herbicides with improved efficacy and reduced environmental impact. By incorporating this compound into the molecular structure of agricultural chemicals, researchers can fine-tune their properties for specific pest targets or weed species.Overall, the versatility and reactivity of 4-Fluoro-3-iodo-1-methyl-1H-indazole make it a valuable asset in the toolkit of synthetic chemists working across various industries. Its potential applications span from drug discovery to materials science, offering new avenues for innovation and discovery in the field of chemical synthesis.