3-[4-(Methanesulfonyl)phenyl]prop-2-yn-1-ol

Base Information

Chemical Name:3-[4-(Methanesulfonyl)phenyl]prop-2-yn-1-ol
CAS No.:105135-96-4
Molecular Formula:C10H10O3S
Molecular Weight:210.254
Hs Code.:
DSSTox Substance ID:DTXSID50579690
Wikidata:Q82470297

Synonyms:105135-96-4;3-[4-(Methanesulfonyl)phenyl]prop-2-yn-1-ol;SCHEMBL2181909;DTXSID50579690

Suppliers and Price of 3-[4-(Methanesulfonyl)phenyl]prop-2-yn-1-ol

Supply Marketing:

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

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Chemical Property of 3-[4-(Methanesulfonyl)phenyl]prop-2-yn-1-ol

Chemical Property:

XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:210.03506535
Heavy Atom Count:14
Complexity:331

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CS(=O)(=O)C1=CC=C(C=C1)C#CCO

Technology Process of 3-[4-(Methanesulfonyl)phenyl]prop-2-yn-1-ol

There total 3 articles about 3-[4-(Methanesulfonyl)phenyl]prop-2-yn-1-ol 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: 77.0%

: 64984-08-3
1-iodo-4-(methylsulfonyl)benzene

: 107-19-7
propargyl alcohol

: 105135-96-4
3-(4-(methylsulfonyl)phenyl)prop-2-yn-1-ol

Guidance literature:: 1-iodo-4-(methylsulfonyl)benzene; propargyl alcohol; With trans-bis(triphenylphosphine)palladium dichloride; diethylamine; at 20 ℃; for 0.25h; Inert atmosphere;

With copper(l) iodide; at 50 ℃; for 3h; Inert atmosphere;
DOI:10.1039/c4ob01583e

Reference yield: 73.0%

: 3466-32-8
4-bromoohenyl methyl sulfone

: 107-19-7
propargyl alcohol

: 105135-96-4
3-(4-(methylsulfonyl)phenyl)prop-2-yn-1-ol

Guidance literature:: bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; In diethylamine; at 55 ℃; for 5h;
DOI:10.1016/S0040-4039(00)96737-6

Reference yield:

: 104-95-0
(4-bromophenyl)thioanisole

: 105135-96-4
3-(4-(methylsulfonyl)phenyl)prop-2-yn-1-ol

Guidance literature:: Multi-step reaction with 2 steps

1: H₂O₂ / acetic acid

2: 73 percent / CuI, PdCl₂(PPh₃)2 / diethylamine / 5 h / 55 °C

With dihydrogen peroxide; bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; In acetic acid; diethylamine;
DOI:10.1016/S0040-4039(00)96737-6