2-(4-Fluorophenyl)ethyl 4-methylbenzenesulfonate

Base Information

Chemical Name:2-(4-Fluorophenyl)ethyl 4-methylbenzenesulfonate
CAS No.:50562-02-2
Molecular Formula:C₁₅H₁₅FO₃S
Molecular Weight:294.347
Hs Code.:
DSSTox Substance ID:DTXSID401203794

Synonyms:2-(4-fluorophenyl)ethyl 4-methylbenzenesulfonate;50562-02-2;SCHEMBL5351657;Toluene-4-sulfonic Acid 2-(4-Fluorophenyl)ethyl Ester;VYTFNVGKANGTGU-UHFFFAOYSA-N;DTXSID401203794;BBL021919;STK894636;AKOS005144465;4-Fluorophenethyl 4-methylbenzenesulfonate;2-(4-fluorophenyl)ethyl p-toluenesulfonate;4-fluorophenethyl 4-methyl-1-benzenesulfonate;EN300-6502618;2-(4-fluorophenyl)ethyl 4-methylbenzene-1-sulfonate;Benzeneethanol, 4-fluoro-, 1-(4-methylbenzenesulfonate);toluene-4-sulfonic acid 2-(4-fluorophenyl)-ethyl ester

Suppliers and Price of 2-(4-Fluorophenyl)ethyl 4-methylbenzenesulfonate

Supply Marketing:

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

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Chemical Property of 2-(4-Fluorophenyl)ethyl 4-methylbenzenesulfonate

Chemical Property:

XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:294.07259367
Heavy Atom Count:20
Complexity:374

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC=C(C=C2)F

Technology Process of 2-(4-Fluorophenyl)ethyl 4-methylbenzenesulfonate

There total 3 articles about 2-(4-Fluorophenyl)ethyl 4-methylbenzenesulfonate 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:

: 34837-84-8
4-fluorobenzeneacetic acid methyl ester

: 50562-02-2
toluene-4-sulfonic Acid 2-(4-Fluorophenyl)ethyl Ester

Guidance literature:: Multi-step reaction with 2 steps

1: lithium aluminium tetrahydride / tetrahydrofuran / 4.5 h / 0 - 20 °C / Inert atmosphere

2: pyridine / 4 h / 0 - 20 °C

With pyridine; lithium aluminium tetrahydride; In tetrahydrofuran;
DOI:10.1016/j.bmc.2017.05.012

Reference yield:

: 7589-27-7
2-(4-Fluorophenyl)ethanol

: 98-59-9
p-toluenesulfonyl chloride

: 50562-02-2
toluene-4-sulfonic Acid 2-(4-Fluorophenyl)ethyl Ester

Guidance literature:: With pyridine; at -5 ℃; for 3h;

Reference yield:

: 405-50-5
p-Fluorophenylacetic acid

: 50562-02-2
toluene-4-sulfonic Acid 2-(4-Fluorophenyl)ethyl Ester

Guidance literature:: Multi-step reaction with 3 steps

1: thionyl chloride / 3 h / 0 - 20 °C

2: lithium aluminium tetrahydride / tetrahydrofuran / 4.5 h / 0 - 20 °C / Inert atmosphere

3: pyridine / 4 h / 0 - 20 °C

With pyridine; lithium aluminium tetrahydride; thionyl chloride; In tetrahydrofuran;
DOI:10.1016/j.bmc.2017.05.012