2-[(4-Ethoxyphenyl)thio]-propanoic acid ethyl ester

Base Information

Chemical Name:2-[(4-Ethoxyphenyl)thio]-propanoic acid ethyl ester
CAS No.:212769-23-8
Molecular Formula:C13H18 O3 S
Molecular Weight:254.35
Hs Code.:
DSSTox Substance ID:DTXSID00448923
Mol file:212769-23-8.mol

Synonyms:212769-23-8;2-[(4-ETHOXYPHENYL)THIO]-PROPANOIC ACID ETHYL ESTER;Ethyl 2-(4-ethoxyphenyl)sulfanylpropanoate;SCHEMBL6930498;DTXSID00448923;NTORWPCYEHSJES-UHFFFAOYSA-N;AKOS015961319;AB24987;AC-13590;Ethyl 2-[(4-ethoxyphenyl)sulfanyl]propanoate;2-(4-ethoxy-phenylsulfanyl)propionic acid ethyl ester;2-(4ethoxy-phenylsulfanyl)-propionic acid ethyl ester;2-(4-ethoxy-phenylsulfanyl)-propionic acid ethyl ester

Suppliers and Price of 2-[(4-Ethoxyphenyl)thio]-propanoic acid ethyl ester

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
2-[(4-ETHOXYPHENYL)THIO]-PROPANOIC ACID ETHYL ESTER 95.00%
5MG
$ 497.89

Total 3 raw suppliers

Chemical Property of 2-[(4-Ethoxyphenyl)thio]-propanoic acid ethyl ester

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Refractive Index:1.531
Boiling Point:345.96°C at 760 mmHg
Flash Point:157.309°C
PSA：60.83000
Density:1.112g/cm³
LogP:3.12900
XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:254.09766561
Heavy Atom Count:17
Complexity:225

Purity/Quality:

98%min ^*data from raw suppliers

2-[(4-ETHOXYPHENYL)THIO]-PROPANOIC ACID ETHYL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC1=CC=C(C=C1)SC(C)C(=O)OCC

Technology Process of 2-[(4-Ethoxyphenyl)thio]-propanoic acid ethyl ester

There total 3 articles about 2-[(4-Ethoxyphenyl)thio]-propanoic acid ethyl ester 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: 98.0%

: 30512-68-6
2-(4-hydroxy-phenylsulfanyl)-propionic acid ethyl ester

: 75-03-6
ethyl iodide

: 212769-23-8
2-(4-ethoxy-phenylsulfanyl)-propionic acid ethyl ester

Guidance literature:: With 18-crown-6 ether; potassium carbonate; In acetone; for 8h; Heating;
DOI:10.1021/jm0205548

Reference yield:

: 637-89-8
4-sulfanylphenol

: 212769-23-8
2-(4-ethoxy-phenylsulfanyl)-propionic acid ethyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 99 percent / Et₃N / acetone; CHCl₃ / 1 h / Heating

2: 98 percent / 18-crown-6; K₂CO₃ / acetone / 8 h / Heating

With 18-crown-6 ether; potassium carbonate; triethylamine; In chloroform; acetone;
DOI:10.1021/jm0205548

Reference yield:

: 535-11-5,41978-69-2
Ethyl 2-bromopropionate

: 212769-23-8
2-(4-ethoxy-phenylsulfanyl)-propionic acid ethyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: 99 percent / Et₃N / acetone; CHCl₃ / 1 h / Heating

2: 98 percent / 18-crown-6; K₂CO₃ / acetone / 8 h / Heating

With 18-crown-6 ether; potassium carbonate; triethylamine; In chloroform; acetone;
DOI:10.1021/jm0205548