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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)-

Boronic acid,B-[3-chloro-4-[(2-fluorophenyl)methoxy]phenyl]-

Clc1cc(ccc1OCc1ccccc1F)B(O)O Request for Quotation
Chemical Name: Boronic acid,B-[3-chloro-4-[(2-fluorophenyl)methoxy]phenyl]-
CAS Number: 870777-28-9
Product Number: AG003J7K(AGN-PC-0VAH6M)
Synonyms:
MDL No:
Molecular Formula: C13H11BClFO3
Molecular Weight: 280.4870

Identification/Properties

Properties
MP:
167-172°C(lit.)
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
280.486g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
280.047g/mol
Monoisotopic Mass:
280.047g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
283
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-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


The (3-Chloro-4-((2-fluorobenzyl)oxy)phenyl)boronic acid is a versatile compound commonly used in chemical synthesis as a key building block. It is particularly valued for its ability to introduce the boronic acid functional group into organic molecules, facilitating further elaboration through cross-coupling reactions. In the realm of medicinal chemistry, this compound can serve as a valuable intermediate in the synthesis of pharmaceutical agents, as the boronic acid moiety enables the formation of biaryl linkages crucial for drug activity. Furthermore, its unique structure allows for strategic modification to tailor the properties of resulting molecules, making it a valuable tool in the design and synthesis of new chemical entities.