1-tert-Butoxycarbonyl-1H-pyrazole-4-boronic acid


Chemical Name: 1-tert-Butoxycarbonyl-1H-pyrazole-4-boronic acid
CAS Number: 947533-31-5
Product Number: AG003E0S(AGN-PC-0712S2)
Synonyms:
MDL No: MFCD09951915
Molecular Formula: C10H17BN2O4
Molecular Weight: 240.0640

Identification/Properties


Properties
MP:
157-161℃
BP:
374.1°C at 760 mmHg
Storage:
2-8℃;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
212.012g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
212.097g/mol
Monoisotopic Mass:
212.097g/mol
Topological Polar Surface Area:
84.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
241
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



(1-(tert-Butoxycarbonyl)-3,5-dimethyl-1H-pyrazol-4-yl)boronic acid, often abbreviated as $name$, is a versatile compound widely used in chemical synthesis due to its unique properties and reactivity. This boronic acid derivative serves as a valuable building block in the synthesis of various pharmaceuticals, agrochemicals, and functional materials.$name$ is commonly employed as a key reagent in Suzuki-Miyaura coupling reactions, a powerful tool in organic synthesis for forming carbon-carbon bonds. By incorporating $name$ into the reaction mixture, chemists can efficiently introduce the pyrazolyl functionality into target molecules, allowing for the synthesis of diverse pyrazole-containing compounds.Moreover, $name$ has found significant utility in the preparation of organoboron compounds, which serve as important intermediates in the synthesis of complex organic molecules. Its tert-butoxycarbonyl (Boc) protecting group provides stability during various synthetic transformations while allowing for selective deprotection under mild conditions when required.In summary, (1-(tert-Butoxycarbonyl)-3,5-dimethyl-1H-pyrazol-4-yl)boronic acid plays a crucial role in modern chemical synthesis, enabling the construction of intricate molecular structures with precision and efficiency. Its versatility and ease of manipulation make it a valuable tool for synthetic chemists across different research fields.