4-(Dodecylsulfanyl)butanoic acid

Base Information

Chemical Name:4-(Dodecylsulfanyl)butanoic acid
CAS No.:40520-14-7
Molecular Formula:C₁₆H₃₂O₂S
Molecular Weight:288.495
Hs Code.:2930909090
NSC Number:35957
DSSTox Substance ID:DTXSID50284151
Nikkaji Number:J429.832B
Wikidata:Q82018983
Mol file:40520-14-7.mol

Synonyms:40520-14-7;4-(dodecylsulfanyl)butanoic acid;4-(Dodecylthio)butyric acid;NSC35957;SCHEMBL4810370;DTXSID50284151;NSC-35957;4-DODECYLSULFANYL-BUTYRIC ACID;AKOS024331250

Suppliers and Price of 4-(Dodecylsulfanyl)butanoic 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

Sigma-Aldrich
4-(DODECYLTHIO)BUTYRIC ACID Aldrich
250mg
$ 57.00

American Custom Chemicals Corporation
4-(DODECYLTHIO)BUTYRIC ACID 95.00%
5MG
$ 502.13

Total 6 raw suppliers

Chemical Property of 4-(Dodecylsulfanyl)butanoic acid

Chemical Property:

Vapor Pressure:3.39E-08mmHg at 25°C
Boiling Point:419°C at 760 mmHg
Flash Point:207.2°C
PSA：62.60000
Density:0.957g/cm³
LogP:5.50530
XLogP3:6.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:15
Exact Mass:288.21230143
Heavy Atom Count:19
Complexity:195

Purity/Quality:

97% ^*data from raw suppliers

4-(DODECYLTHIO)BUTYRIC ACID Aldrich ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCCCCCCCCCCSCCCC(=O)O

Technology Process of 4-(Dodecylsulfanyl)butanoic acid

There total 5 articles about 4-(Dodecylsulfanyl)butanoic 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: 90.0%

: 2969-81-5
Ethyl 4-bromobutyrate

: 112-55-0
1-dodecylthiol

: 40520-14-7
4-Dodecylmercapto-buttersaeure

Guidance literature:: Ethyl 4-bromobutyrate; 1-dodecylthiol; With potassium hydroxide; ethanol; at 20 ℃; for 3h; Heating / reflux;

In water; Acidic aqueous solution;

Reference yield:

: 112-55-0
1-dodecylthiol

: 40520-14-7
4-Dodecylmercapto-buttersaeure

Guidance literature:: With ethanol; sodium ethanolate; und anschliessenden Erwaermen mit 4-Chlor-buttersaeure;
DOI:10.1021/ja01137a506

Reference yield:

: 26960-77-0
sodium dodecanethiolate

: 40520-14-7
4-Dodecylmercapto-buttersaeure

Guidance literature:: Multi-step reaction with 2 steps

1: ethanol

2: lithium; diethyl ether / anschliessendes Behandeln mit festem Kohlendioxid

With diethyl ether; ethanol; lithium;
DOI:10.1021/ja01137a506