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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)-

Benzoic acid, 3-borono-5-fluoro-4-methyl-

OB(c1cc(cc(c1C)F)C(=O)O)O Request for Quotation
Chemical Name: Benzoic acid, 3-borono-5-fluoro-4-methyl-
CAS Number: 917223-87-1
Product Number: AG00H2U1(AGN-PC-0HAFUR)
Synonyms:
MDL No:
Molecular Formula: C8H8BFO4
Molecular Weight: 197.9561232

Identification/Properties

Computed Properties
Molecular Weight:
197.956g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
198.05g/mol
Monoisotopic Mass:
198.05g/mol
Topological Polar Surface Area:
77.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
223
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


3-Borono-5-fluoro-4-methylbenzoic acid is a versatile compound that plays a crucial role in chemical synthesis processes. This compound is frequently utilized as a key building block in the creation of various pharmaceuticals, agrochemicals, and materials. Its boronic acid functional group enables it to participate in important organic reactions, particularly Suzuki-Miyaura cross-coupling reactions. In this context, 3-Borono-5-fluoro-4-methylbenzoic acid serves as a valuable component for forming carbon-carbon bonds, which is essential in the preparation of complex organic molecules. Additionally, this compound can be employed in the synthesis of fluorinated compounds, offering opportunities to introduce unique properties or functionalities into the target molecules. Furthermore, its presence in chemical synthesis enables the development of new synthetic methodologies and strategies, contributing to advancements in the field of organic chemistry.