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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)-

(2-amino-4-chlorophenyl)boronic acid

Clc1ccc(c(c1)N)B(O)O Request for Quotation
Chemical Name: (2-amino-4-chlorophenyl)boronic acid
CAS Number: 948592-74-3
Product Number: AG005U8G(AGN-PC-02PK96)
Synonyms:
MDL No:
Molecular Formula: C6H7BClNO2
Molecular Weight: 171.3893

Identification/Properties

Properties
Storage:
2-8℃;
Computed Properties
Molecular Weight:
171.387g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
171.026g/mol
Monoisotopic Mass:
171.026g/mol
Topological Polar Surface Area:
66.5A^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:
H302-H312-H332
Precautionary Statements:
P261-P264-P270-P271-P280-P301+P312-P302+P352-P304+P340-P330-P363-P501
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


The (2-Amino-4-chlorophenyl)boronic acid is a valuable reagent widely used in organic synthesis due to its versatile and unique chemical properties. This compound is commonly employed as a key building block in Suzuki-Miyaura cross-coupling reactions, a powerful method for forming carbon-carbon bonds. By coupling (2-Amino-4-chlorophenyl)boronic acid with a suitable aryl or heteroaryl halide in the presence of a palladium catalyst, chemists can efficiently generate a diverse range of biaryl compounds. These biaryl products are crucial intermediates in the synthesis of pharmaceuticals, agrochemicals, and materials science. The (2-Amino-4-chlorophenyl)boronic acid's ability to participate in these coupling reactions with high efficiency and selectivity makes it an indispensable tool for modern chemical synthesis. Additionally, this compound can be utilized in other transformations such as Buchwald-Hartwig amination and direct C-H arylation, further expanding its synthetic utility in the creation of complex organic molecules.