[7-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid


Chemical Name: [7-methoxy-1-[(2-methylpropan-2-yl)oxycarbonyl]indol-2-yl]boronic acid
CAS Number: 913835-81-1
Product Number: AG00GTD2(AGN-PC-07138S)
Synonyms:
MDL No: MFCD08689542
Molecular Formula: C14H18BNO5
Molecular Weight: 291.1074

Identification/Properties


Computed Properties
Molecular Weight:
291.11g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
291.128g/mol
Monoisotopic Mass:
291.128g/mol
Topological Polar Surface Area:
80.9A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
384
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


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



$name$ is a versatile chemical compound widely utilized in chemical synthesis for its unique properties and reactivity. With its (1-(tert-Butoxycarbonyl)-7-methoxy-1H-indol-2-yl)boronic acid functional group, this compound serves as a key building block in the development of various organic molecules.Due to its boronic acid moiety, $name$ can participate in Suzuki-Miyaura cross-coupling reactions, enabling the formation of carbon-carbon bonds. This reaction is crucial in the construction of complex organic structures, making $name$ an essential component in the synthesis of pharmaceuticals, agrochemicals, and advanced materials.Furthermore, the presence of the (1-(tert-Butoxycarbonyl)-7-methoxy-1H-indol-2-yl) group confers specific properties to the resulting molecules, such as enhanced stability and solubility. This allows for precise modification and fine-tuning of the final compounds, making $name$ a valuable tool for chemists in the design and optimization of novel chemical entities.In summary, the application of $name$ in chemical synthesis extends beyond simple reactions, offering a myriad of possibilities for the creation of sophisticated organic compounds with tailored properties and functionalities.