1H-Indazole,3-iodo-6-methoxy-


Chemical Name: 1H-Indazole,3-iodo-6-methoxy-
CAS Number: 936138-17-9
Product Number: AG006EWU(AGN-PC-0W36V3)
Synonyms:
MDL No:
Molecular Formula: C8H7IN2O
Molecular Weight: 274.0584

Identification/Properties


Properties
MP:
171 °C
BP:
393.1 °C at 760 mmHg
Storage:
Light sensitive;Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
274.061g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
273.96g/mol
Monoisotopic Mass:
273.96g/mol
Topological Polar Surface Area:
37.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
167
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


NMR Spectrum


Other Analytical Data


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Chemical Structure



3-Iodo-6-methoxy-1H-indazole is a versatile compound widely used in chemical synthesis. It serves as a valuable building block in the pharmaceutical industry and organic chemistry research. This compound is particularly sought after for its unique reactivity and ability to participate in various coupling reactions, such as Suzuki-Miyaura cross-coupling and Buchwald-Hartwig amination. Additionally, 3-Iodo-6-methoxy-1H-indazole can be utilized in the synthesis of complex heterocyclic compounds and drug candidates. Its distinct structural features make it an important intermediate for the preparation of bioactive molecules with potential therapeutic applications.