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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, [4-[(1,1-dimethylethyl)thio]phenyl]-

OB(c1ccc(cc1)SC(C)(C)C)O Request for Quotation
Chemical Name: Boronic acid, [4-[(1,1-dimethylethyl)thio]phenyl]-
CAS Number: 820972-68-7
Product Number: AG0051VG(AGN-PC-0NI09T)
Synonyms:
MDL No:
Molecular Formula: C10H15BO2S
Molecular Weight: 210.1009

Identification/Properties

Properties
MP:
168-170℃(Solv: ethyl ether (60-29-7); hexane (110-54-3))
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
210.098g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
210.089g/mol
Monoisotopic Mass:
210.089g/mol
Topological Polar Surface Area:
65.8A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
172
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


(4-(tert-Butylthio)phenyl)boronic acid is a versatile compound commonly used in chemical synthesis as a key building block for creating various organic molecules. Its unique structure containing both boronic acid and phenyl moieties makes it valuable in a wide range of synthetic processes.One important application of (4-(tert-Butylthio)phenyl)boronic acid is in Suzuki-Miyaura cross-coupling reactions, a powerful tool in organic chemistry for creating carbon-carbon bonds. In this type of reaction, the boronic acid group of (4-(tert-Butylthio)phenyl)boronic acid reacts with an aryl or vinyl halide in the presence of a palladium catalyst to form a new carbon-carbon bond. This enables the synthesis of complex organic molecules with high efficiency and selectivity.Additionally, (4-(tert-Butylthio)phenyl)boronic acid is used in the preparation of pharmaceuticals, agrochemicals, materials science, and other areas of research where precise control over carbon-carbon bond formation is crucial. Its unique steric and electronic properties make it a valuable tool for chemists seeking to create novel structures or modify existing molecules in a controlled manner.