1H-indazol-3-ylboronic acid


Chemical Name: 1H-indazol-3-ylboronic acid
CAS Number: 937366-55-7
Product Number: AG00H183(AGN-PC-0WAKF4)
Synonyms:
MDL No:
Molecular Formula: C13H17BN2O2
Molecular Weight: 244.0973

Identification/Properties


Properties
Storage:
-10 ℃;
Computed Properties
Molecular Weight:
244.101g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
244.138g/mol
Monoisotopic Mass:
244.138g/mol
Topological Polar Surface Area:
47.1A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
319
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



3-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole is a valuable reagent in chemical synthesis due to its unique boronic acid functionality. This compound serves as a versatile building block in the formation of complex organic molecules through Suzuki-Miyaura cross-coupling reactions. By incorporating this indazole derivative into a synthetic pathway, chemists can efficiently introduce the tetramethylboronate group into target molecules, facilitating the creation of new pharmaceuticals, agrochemicals, and materials with enhanced properties. Its stability and reactivity make it a key tool for medicinal chemists and researchers seeking to design and produce innovative compounds with potential biological activities.