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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

(4-bromo-2,5-dimethoxyphenyl)boronic acid

COc1cc(B(O)O)c(cc1Br)OC Request for Quotation
Chemical Name: (4-bromo-2,5-dimethoxyphenyl)boronic acid
CAS Number: 950846-26-1
Product Number: AG00IIQ7(AGN-PC-03X8MP)
Synonyms:
MDL No:
Molecular Formula: C8H10BBrO4
Molecular Weight: 260.8776

Identification/Properties

Computed Properties
Molecular Weight:
260.878g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
259.986g/mol
Monoisotopic Mass:
259.986g/mol
Topological Polar Surface Area:
58.9A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
181
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:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


(4-Bromo-2,5-dimethoxyphenyl)boronic acid is a versatile compound widely used in chemical synthesis as a key building block in the formation of various organic molecules. It plays a crucial role in Suzuki-Miyaura cross-coupling reactions, where it serves as a boronate ester to facilitate the coupling of aryl halides with aryl or vinyl boronic acids under catalytic conditions, leading to the formation of biaryl or polyaryl compounds. This process is highly valuable in the pharmaceutical industry for the synthesis of complex drug molecules, agrochemicals, and materials science for designing novel polymers and organic electronic materials. Additionally, (4-Bromo-2,5-dimethoxyphenyl)boronic acid is also employed in the preparation of diverse heterocyclic compounds, natural product synthesis, and functional materials due to its compatibility with a wide range of functional groups and its ability to enable the construction of intricate molecular structures with high efficiency and selectivity. By serving as a pivotal intermediate in organic synthesis, this compound demonstrates significant utility in advancing the development of new chemical entities and innovative materials for various industrial applications.