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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, (3-chloro-2-fluorophenyl)-

OB(c1cccc(c1F)Cl)O Request for Quotation
Chemical Name: Boronic acid, (3-chloro-2-fluorophenyl)-
CAS Number: 352535-82-1
Product Number: AG0035TC(AGN-PC-00UQ9T)
Synonyms:
MDL No: MFCD05664224
Molecular Formula: C6H5BClFO2
Molecular Weight: 174.3651

Identification/Properties

Properties
MP:
223 °C (dec.)(lit.)
BP:
315.1°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
174.362g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
174.006g/mol
Monoisotopic Mass:
174.006g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
136
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


3-chloro-2-fluorophenylboronic acid is a versatile building block in chemical synthesis due to its unique properties and reactivity. This compound is commonly used as a key component in the construction of various pharmaceuticals, agrochemicals, and materials science applications. In organic synthesis, 3-chloro-2-fluorophenylboronic acid acts as a valuable substrate for Suzuki-Miyaura cross-coupling reactions, enabling the formation of biaryl compounds with excellent efficiency and selectivity. This compound can also serve as a precursor for the introduction of functional groups or pharmacophores into complex molecules, making it an essential tool for medicinal chemistry and drug discovery research. Additionally, 3-chloro-2-fluorophenylboronic acid can participate in transition metal-catalyzed reactions, such as C-H activation and C-C bond formation, expanding its utility in the synthesis of diverse organic compounds with tailored properties.