Ethyl 2-(benzylsulfanyl)propanoate

Base Information Edit

Chemical Name:Ethyl 2-(benzylsulfanyl)propanoate
CAS No.:52414-72-9
Molecular Formula:C₁₂H₁₆O₂S
Molecular Weight:224.324
Hs Code.:
DSSTox Substance ID:DTXSID60544697
Nikkaji Number:J2.764.990D
Mol file:52414-72-9.mol

Synonyms:52414-72-9;Ethyl 2-(benzylsulfanyl)propanoate;Ethyl 2-(benzylthio)propanoate;ethyl 2-benzylsulfanylpropanoate;Ethyl2-(benzylthio)propanoate;SCHEMBL11770013;DTXSID60544697;CCA41472;AKOS010483644

Suppliers and Price of Ethyl 2-(benzylsulfanyl)propanoate

Supply Marketing:Edit

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

Manufacturers and distributors:

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Total 1 raw suppliers

Chemical Property of Ethyl 2-(benzylsulfanyl)propanoate Edit

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:224.08710092
Heavy Atom Count:15
Complexity:188

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C(C)SCC1=CC=CC=C1

Technology Process of Ethyl 2-(benzylsulfanyl)propanoate

There total 3 articles about Ethyl 2-(benzylsulfanyl)propanoate 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:

: 6182-85-0,2899-64-1
2-(benzylthio)propanoic acid

: 52414-72-9
ethyl alpha-(benzylmercapto)-propionate

Guidance literature:: Multi-step reaction with 2 steps

1: thionyl chloride; pyridine / CH₂Cl₂ / 0.83 h / Heating

2: 10.6 g / CH₂Cl₂ / 0.17 h / 60 - 70 °C

With pyridine; thionyl chloride; In dichloromethane;
DOI:10.1016/j.tetasy.2005.07.009

Reference yield:

: 100-39-0
benzyl bromide

: 52414-72-9
ethyl alpha-(benzylmercapto)-propionate

Guidance literature:: Multi-step reaction with 3 steps

1: potassium carbonate / acetone / 24 h

2: thionyl chloride; pyridine / CH₂Cl₂ / 0.83 h / Heating

3: 10.6 g / CH₂Cl₂ / 0.17 h / 60 - 70 °C

With pyridine; thionyl chloride; potassium carbonate; In dichloromethane; acetone;
DOI:10.1016/j.tetasy.2005.07.009