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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)-

[3-(2-hydroxypropan-2-yl)phenyl]boronic acid

OB(c1cccc(c1)C(O)(C)C)O Request for Quotation
Chemical Name: [3-(2-hydroxypropan-2-yl)phenyl]boronic acid
CAS Number: 955369-43-4
Product Number: AG00IJ6Q(AGN-PC-09TE8X)
Synonyms:
MDL No:
Molecular Formula: C9H13BO3
Molecular Weight: 180.0087

Identification/Properties

Computed Properties
Molecular Weight:
180.01g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
180.096g/mol
Monoisotopic Mass:
180.096g/mol
Topological Polar Surface Area:
60.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
170
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-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


(3-(2-Hydroxypropan-2-yl)phenyl)boronic acid is a versatile compound widely utilized in chemical synthesis as a crucial building block in organic reactions. Due to its boronic acid functionality, this compound serves as a valuable precursor for the formation of various carbon-carbon and carbon-heteroatom bonds in organic molecules. In the field of medicinal chemistry, (3-(2-Hydroxypropan-2-yl)phenyl)boronic acid is frequently employed in the synthesis of pharmaceutical intermediates and drug candidates. Its ability to participate in Suzuki-Miyaura cross-coupling reactions enables the assembly of complex molecular frameworks with high efficiency and selectivity. Moreover, this compound has found applications in the preparation of biologically active compounds, such as inhibitors and ligands targeting specific proteins or enzymes.Furthermore, (3-(2-Hydroxypropan-2-yl)phenyl)boronic acid plays a vital role in the development of advanced materials. By incorporating the boronic acid moiety into polymer chains or supramolecular structures, researchers can tailor the properties of materials for various applications, including sensing, catalysis, and drug delivery systems.In summary, the unique reactivity and versatility of (3-(2-Hydroxypropan-2-yl)phenyl)boronic acid make it an indispensable reagent in modern organic synthesis, offering limitless possibilities for the creation of novel compounds and functional materials.