Boronic acid, [4-(methoxymethyl)phenyl]-


Chemical Name: Boronic acid, [4-(methoxymethyl)phenyl]-
CAS Number: 279262-11-2
Product Number: AG00BDTA(AGN-PC-0KZ67Y)
Synonyms:
MDL No:
Molecular Formula: C8H11BO3
Molecular Weight: 165.9821

Identification/Properties


Computed Properties
Molecular Weight:
165.983g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
166.08g/mol
Monoisotopic Mass:
166.08g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
122
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



(4-(Methoxymethyl)phenyl)boronic acid is a versatile chemical compound that finds wide application in organic synthesis. One of its key roles in chemical synthesis is as a boronic acid derivative that can undergo various Suzuki-Miyaura cross-coupling reactions. This compound serves as a valuable building block in the formation of carbon-carbon bonds, enabling the creation of complex organic molecules. Through its Boron atom, (4-(Methoxymethyl)phenyl)boronic acid facilitates the coupling of aryl boronic acids with aryl halides or pseudohalides under palladium-catalyzed conditions. This reaction is widely used in pharmaceutical, agrochemical, and material science industries for the synthesis of biologically active compounds, fine chemicals, and advanced materials. Its compatibility with a variety of functional groups and its ability to participate in selective cross-coupling reactions make (4-(Methoxymethyl)phenyl)boronic acid a valuable tool for chemists in the design and synthesis of complex molecules.