(5-methoxycarbonyl-1H-pyrrol-2-yl)boronic acid


Chemical Name: (5-methoxycarbonyl-1H-pyrrol-2-yl)boronic acid
CAS Number: 1217500-64-5
Product Number: AG0015R8(AGN-PC-09PYWW)
Synonyms:
MDL No:
Molecular Formula: C6H8BNO4
Molecular Weight: 168.9430

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
168.943g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
169.055g/mol
Monoisotopic Mass:
169.055g/mol
Topological Polar Surface Area:
82.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
175
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



(5-(Methoxycarbonyl)-1H-pyrrol-2-yl)boronic acid is a versatile compound widely used in chemical synthesis as a key building block. Its unique structure allows for the functionalization of organic molecules, making it an essential reagent in the development of various pharmaceuticals, agrochemicals, and materials.In organic synthesis, (5-(Methoxycarbonyl)-1H-pyrrol-2-yl)boronic acid serves as a valuable starting material for the construction of heterocyclic compounds, which are essential in drug discovery and development. Its boronic acid functionality enables cross-coupling reactions with a variety of electrophiles, such as aryl halides, to form carbon-carbon and carbon-heteroatom bonds. This versatility allows for the creation of complex molecular structures with high efficiency.Additionally, (5-(Methoxycarbonyl)-1H-pyrrol-2-yl)boronic acid can be utilized in the synthesis of boron-containing polymers and materials with specific properties, such as optoelectronic devices and sensors. Its presence in the molecular framework imparts unique characteristics to the resulting materials, making them suitable for diverse applications in the fields of electronics, photonics, and catalysis.Overall, the application of (5-(Methoxycarbonyl)-1H-pyrrol-2-yl)boronic acid in chemical synthesis highlights its significance as a versatile and valuable reagent with broad implications in the development of novel compounds and materials for various industrial sectors.