4,4,5,5-Tetramethyl-2-(4-methylsulfanylmethoxy-phenyl)-[1,3,2]dioxaborolane

Base Information

Chemical Name:4,4,5,5-Tetramethyl-2-(4-methylsulfanylmethoxy-phenyl)-[1,3,2]dioxaborolane
CAS No.:864754-50-7
Molecular Formula:C₁₄H₂₁BO₃S
Molecular Weight:280.196
Hs Code.:
DSSTox Substance ID:DTXSID30590121
Wikidata:Q82483797
Mol file:864754-50-7.mol

Synonyms:864754-50-7;4,4,5,5-TETRAMETHYL-2-(4-METHYLSULFANYLMETHOXY-PHENYL)-[1,3,2]DIOXABOROLANE;4,4,5,5-tetramethyl-2-[4-(methylsulfanylmethoxy)phenyl]-1,3,2-dioxaborolane;4-(Methylthiomethoxy)phenylboronic acid pinacol ester;DTXSID30590121;DB-357621;4,4,5,5-Tetramethyl-2-(4-((methylthio)methoxy)phenyl)-1,3,2-dioxaborolane;4,4,5,5-Tetramethyl-2-{4-[(methylsulfanyl)methoxy]phenyl}-1,3,2-dioxaborolane

Suppliers and Price of 4,4,5,5-Tetramethyl-2-(4-methylsulfanylmethoxy-phenyl)-[1,3,2]dioxaborolane

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
4,4,5,5-TETRAMETHYL-2-(4-METHYLSULFANYLMETHOXY-PHENYL)-[1,3,2]DIOXABOROLANE 95.00%
10G
$ 4735.50

American Custom Chemicals Corporation
4,4,5,5-TETRAMETHYL-2-(4-METHYLSULFANYLMETHOXY-PHENYL)-[1,3,2]DIOXABOROLANE 95.00%
5G
$ 3580.50

American Custom Chemicals Corporation
4,4,5,5-TETRAMETHYL-2-(4-METHYLSULFANYLMETHOXY-PHENYL)-[1,3,2]DIOXABOROLANE 95.00%
1G
$ 1674.75

Total 6 raw suppliers

Chemical Property of 4,4,5,5-Tetramethyl-2-(4-methylsulfanylmethoxy-phenyl)-[1,3,2]dioxaborolane

Chemical Property:

PSA：52.99000
LogP:2.68510
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:280.1304459
Heavy Atom Count:19
Complexity:285

Purity/Quality:

97% ^*data from raw suppliers

4,4,5,5-TETRAMETHYL-2-(4-METHYLSULFANYLMETHOXY-PHENYL)-[1,3,2]DIOXABOROLANE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)OCSC

Technology Process of 4,4,5,5-Tetramethyl-2-(4-methylsulfanylmethoxy-phenyl)-[1,3,2]dioxaborolane

There total 2 articles about 4,4,5,5-Tetramethyl-2-(4-methylsulfanylmethoxy-phenyl)-[1,3,2]dioxaborolane which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 108-95-2,27073-41-2
phenol

: 4,4,5,5-tetramethyl-2-(2-((methylthio)methoxy)phenyl)-1,3,2-dioxaborolane

: 864754-50-7
C₁₄H₂₁BO₃S

Guidance literature:: Multi-step reaction with 2 steps

1.1: sodium hydride / N,N-dimethyl-formamide / 1.5 h / 0 °C / Inert atmosphere

1.2: 2.5 h / 0 °C / Inert atmosphere

2.1: (1,5-cyclooctadiene)(methoxy)iridium(I) dimer; 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; 4,4'-di-tert-butyl-2,2'-bipyridine / para-xylene / 24 h / 80 °C / Sealed tube; Inert atmosphere

With (1,5-cyclooctadiene)(methoxy)iridium(I) dimer; sodium hydride; 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; 4,4'-di-tert-butyl-2,2'-bipyridine; In para-xylene; N,N-dimethyl-formamide;
DOI:10.1021/acs.orglett.7b02936

Reference yield:

: 33837-96-6
methyl thiomethyl ether of phenol

: 73183-34-3
bis(pinacol)diborane

: 4,4,5,5-tetramethyl-2-(3-((methylthio)methoxy)phenyl)-1,3,2-dioxaborolane

: 4,4,5,5-tetramethyl-2-(2-((methylthio)methoxy)phenyl)-1,3,2-dioxaborolane

: 864754-50-7
C₁₄H₂₁BO₃S

Guidance literature:: With (1,5-cyclooctadiene)(methoxy)iridium(I) dimer; 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; 4,4'-di-tert-butyl-2,2'-bipyridine; In para-xylene; at 80 ℃; for 24h; Reagent/catalyst; Overall yield = 88 %; Overall yield = 123 mg; Catalytic behavior; Sealed tube; Inert atmosphere;
DOI:10.1021/acs.orglett.7b02936