3-[(3,4-Dimethoxyphenyl)sulfanyl]propanoic acid

Base Information

Chemical Name:3-[(3,4-Dimethoxyphenyl)sulfanyl]propanoic acid
CAS No.:60169-56-4
Molecular Formula:C11H14O4S
Molecular Weight:242.29100
Hs Code.:
DSSTox Substance ID:DTXSID40596295
Wikidata:Q82491516

Synonyms:3-[(3,4-dimethoxyphenyl)sulfanyl]propanoic acid;60169-56-4;3-(3,4-dimethoxyphenyl)sulfanylpropanoic acid;SCHEMBL8471824;DTXSID40596295;HVWIZKGQLSYPCB-UHFFFAOYSA-N;AKOS029462794;3-(3,4-dimethoxyphenylthio)propanoic acid;CS-0262529;EN300-83068;3-[(3,4-dimethoxyphenyl)sulfanyl]propanoicacid;Z1238558898

Suppliers and Price of 3-[(3,4-Dimethoxyphenyl)sulfanyl]propanoic acid

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

AK Scientific
3-[(3,4-Dimethoxyphenyl)sulfanyl]propanoicacid
10g
$ 1271.00

AK Scientific
3-[(3,4-Dimethoxyphenyl)sulfanyl]propanoicacid
5g
$ 891.00

AK Scientific
3-[(3,4-Dimethoxyphenyl)sulfanyl]propanoicacid
1g
$ 372.00

Total 3 raw suppliers

Chemical Property of 3-[(3,4-Dimethoxyphenyl)sulfanyl]propanoic acid

Chemical Property:

Melting Point:75-76 °C(Solv: ligroine (8032-32-4))
Boiling Point:399.1±42.0 °C(Predicted)
PSA：81.06000
Density:1.25±0.1 g/cm3(Predicted)
LogP:2.27060
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:242.06128010
Heavy Atom Count:16
Complexity:222

Purity/Quality:

99% ^*data from raw suppliers

3-[(3,4-Dimethoxyphenyl)sulfanyl]propanoicacid ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=C(C=C(C=C1)SCCC(=O)O)OC

Technology Process of 3-[(3,4-Dimethoxyphenyl)sulfanyl]propanoic acid

There total 6 articles about 3-[(3,4-Dimethoxyphenyl)sulfanyl]propanoic acid 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: 76.0%

: 700-96-9
3,4-dimethoxythiophenol

: 79-10-7
acrylic acid

: 60169-56-4
3-(3,4-dimethoxyphenylthio)propanoic acid

Guidance literature:: In ethyl acetate;

Reference yield:

: C₁₃H₁₈O₄S

: 60169-56-4
3-(3,4-dimethoxyphenylthio)propanoic acid

Guidance literature:: With sodium hydroxide; In methanol; at 80 ℃; for 1h;
DOI:10.1016/j.ejmech.2022.114305

Reference yield:

: 700-96-9
3,4-dimethoxythiophenol

: 60169-56-4
3-(3,4-dimethoxyphenylthio)propanoic acid

Guidance literature:: Multi-step reaction with 2 steps

1: potassium carbonate / acetonitrile / 3 h / 20 °C

2: sodium hydroxide / methanol / 1 h / 80 °C

With potassium carbonate; sodium hydroxide; In methanol; acetonitrile;
DOI:10.1016/j.ejmech.2022.114305