[3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]boronic acid


Chemical Name: [3-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]boronic acid
CAS Number: 380430-68-2
Product Number: AG00I7HL(AGN-PC-0KKVA6)
Synonyms:
MDL No: MFCD03411945
Molecular Formula: C11H16BNO4
Molecular Weight: 237.0600

Identification/Properties


Properties
MP:
160-170°C
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
237.062g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
237.117g/mol
Monoisotopic Mass:
237.117g/mol
Topological Polar Surface Area:
78.8A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
265
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



The (3-Boc-Aminophenyl)boronic acid is a versatile compound widely utilized in chemical synthesis for its unique reactivity and structural properties. As a boronic acid derivative, it serves as a valuable building block in the formation of C-C, C-N, and C-O bonds through Suzuki-Miyaura cross-coupling reactions. This allows for the efficient and selective creation of complex organic molecules with diverse functionalities.In particular, (3-Boc-Aminophenyl)boronic acid finds application in the synthesis of pharmaceutical compounds, agrochemicals, and materials science. Its compatibility with various functional groups and mild reaction conditions make it a preferred reagent in the design and production of biologically active molecules and advanced materials. Additionally, the Boc (tert-butoxycarbonyl) protecting group enhances the stability and solubility of the compound, facilitating its manipulation in multiple synthetic pathways.Furthermore, the (3-Boc-Aminophenyl)boronic acid contributes to the development of new synthetic methodologies and strategies in organic chemistry, enabling chemists to access previously inaccessible chemical space. Its strategic placement of the boronic acid moiety and Boc protecting group offer strategic handles for further functionalization and derivatization, expanding the scope of synthetic possibilities in the field.Overall, the (3-Boc-Aminophenyl)boronic acid represents a valuable tool in the toolkit of synthetic chemists, offering a reliable and efficient means to construct complex molecular structures with precision and control. Its wide-ranging applications in chemical synthesis highlight its significance in modern organic chemistry research and development.