Dimethyl(4-chlorophenyl)silanol

Base Information

• Chemical Name: Dimethyl(4-chlorophenyl)silanol
• CAS No.: 18246-04-3
• Molecular Formula: C8H11 Cl O Si
• Molecular Weight: 186.713
• Hs Code.: 2931900090
• DSSTox Substance ID: DTXSID30557335
• Nikkaji Number: J2.653.414C
• Wikidata: Q82439196
• Mol file: 18246-04-3.mol

Synonyms:DIMETHYL(4-CHLOROPHENYL)SILANOL;18246-04-3;4-chlorophenyldimethylsilanol;(4-chlorophenyl)dimethylsilanol;(4-chlorophenyl)-hydroxy-dimethylsilane;(4-Chlorophenyl)(dimethyl)silanol;SCHEMBL2921010;DTXSID30557335;MFCD09266144;AKOS006331072;BS-21803;Silanol, 1-(4-chlorophenyl)-1,1-dimethyl-;A926589

Chemical Property of Dimethyl(4-chlorophenyl)silanol

Chemical Property:

• PSA: 20.23000
• LogP: 1.74440
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 186.0267692
• Heavy Atom Count: 11
• Complexity: 130

Purity/Quality:

97% ^*data from raw suppliers

Dimethyl(4-chlorophenyl)silanol ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[Si](C)(C1=CC=C(C=C1)Cl)O

Technology Process of Dimethyl(4-chlorophenyl)silanol

There total 13 articles about Dimethyl(4-chlorophenyl)silanol 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: 96.0%

(4-chlorophenyl)dimethylsilane (1432-31-1) → dimethyl(4-chlorophenyl)silanol (18246-04-3)

Guidance literature:

With Ethyl 2-mercaptopropionate; (4s,6s)-2,4,5,6-tetra(9H-carbazol-9-yl)isophthalonitrile; water; In acetonitrile; at 20 ℃; Irradiation; Inert atmosphere; Schlenk technique; Green chemistry;

DOI:10.1039/d1gc02805g

Reference yield: 87.0%

bromochlorobenzene (106-39-8) + Hexamethylcyclotrisiloxane (541-05-9) → dimethyl(4-chlorophenyl)silanol (18246-04-3)

Guidance literature:

bromochlorobenzene; With tert.-butyl lithium; In diethyl ether; at -78 - -60 ℃; Inert atmosphere;

Hexamethylcyclotrisiloxane; In diethyl ether; at -74 ℃; Inert atmosphere;

DOI:10.1021/ja8091449

Reference yield: 79.0%

C9H13ClOSi (106773-95-9) → dimethyl(4-chlorophenyl)silanol (18246-04-3)

Guidance literature:

C₉H₁₃ClOSi; With 2,2,6,6-tetramethyl-piperidine-N-oxyl; potassium bromide; In acetone; at 20 ℃; for 0.166667h;

With sodium hypochlorite; sodium hydrogencarbonate; In water; acetone; at 20 ℃; for 1h;

DOI:10.1246/cl.2009.532

upstream raw materials:

4-chlorophenyldimethylchlorosilane

p-Chlorphenyldimethylmethoxysilan

bromochlorobenzene

(4-chlorophenyl)dimethylsilane

Downstream raw materials:

C₂₁H₃₆Cl₂O₄Si₅

methanol

p-Chlorphenyldimethylmethoxysilan

potassium (4-chlorophenyl)dimethylsilanolate

Refernces

• 1、 -. "Silicon-center chiral silicon-oxygen compound and preparation method thereof". Paragraph 0106-0109; 0111-0112; 0114. . Retrieved 2021/07/24.
• 2、 Zhu, Jiefeng,Chen, Shuyou,He, Chuan. "Catalytic Enantioselective Dehydrogenative Si-O Coupling to Access Chiroptical Silicon-Stereogenic Siloxanes and Alkoxysilanes". . p. 5301 - 5307. Retrieved 2021/05/04.