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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-[(dimethylamino)carbonyl]phenyl]-

CN(C(=O)c1cccc(c1)B(O)O)C Request for Quotation
Chemical Name: Boronic acid, [3-[(dimethylamino)carbonyl]phenyl]-
CAS Number: 373384-14-6
Product Number: AG00BYXQ(AGN-PC-0KKVEJ)
Synonyms:
MDL No:
Molecular Formula: C9H12BNO3
Molecular Weight: 193.0075

Identification/Properties

Properties
MP:
122-128°C
BP:
422.9°C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
193.009g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
193.091g/mol
Monoisotopic Mass:
193.091g/mol
Topological Polar Surface Area:
60.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
208
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#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


(3-(Dimethylcarbamoyl)phenyl)boronic acid, a versatile compound in chemical synthesis, is commonly employed as a key building block in the creation of various pharmaceuticals, agrochemicals, and materials. Its unique structure and reactivity make it a valuable tool for organic chemists seeking to introduce the phenylboronic acid functionality into complex molecules.One of the primary applications of (3-(Dimethylcarbamoyl)phenyl)boronic acid is its use in Suzuki-Miyaura cross-coupling reactions. In this reaction, the boronic acid moiety of the compound can react with aryl halides or pseudohalides in the presence of a palladium catalyst to form carbon-carbon bonds. This powerful transformation allows for the synthesis of biaryl compounds, which are prevalent in many natural products and pharmaceuticals.Additionally, (3-(Dimethylcarbamoyl)phenyl)boronic acid can serve as a directing group in C-H activation reactions. By utilizing the boronic acid functionality as a directing group, chemists can selectively functionalize specific C-H bonds within a molecule, enabling the synthesis of complex structures with high regioselectivity.Overall, the use of (3-(Dimethylcarbamoyl)phenyl)boronic acid in chemical synthesis highlights its importance as a valuable tool for the construction of diverse and intricate organic molecules.