ethyl N-phenylbutanimidothioate

Base Information

Chemical Name:ethyl N-phenylbutanimidothioate
CAS No.:19255-90-4
Molecular Formula:C12H17NS
Molecular Weight:207.34
Hs Code.:
European Community (EC) Number:654-298-8
NSC Number:97071
DSSTox Substance ID:DTXSID90294552
Mol file:19255-90-4.mol

Synonyms:19255-90-4;ethyl N-phenylbutanimidothioate;ethyl(1z)-n-phenylbutanimidothioate;NSC97071;ethyl N-phenylthio-butyrimidate;SCHEMBL1815246;SCHEMBL12627929;DTXSID90294552;UWUDNZHWOOEBGE-UHFFFAOYSA-N;NSC-97071;AKOS024332759;N-[1-(ethylsulfanyl)butylidene]aniline;Butyrimidicthio acid, N-phenyl-, ehtyl ester

Suppliers and Price of ethyl N-phenylbutanimidothioate

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

Total 4 raw suppliers

Chemical Property of ethyl N-phenylbutanimidothioate

Chemical Property:

Vapor Pressure:0.00478mmHg at 25°C
Boiling Point:285.6°Cat760mmHg
Flash Point:126.5°C
Density:0.96g/cm³
XLogP3:3.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:207.10817072
Heavy Atom Count:14
Complexity:171

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCCC(=NC1=CC=CC=C1)SCC

Technology Process of ethyl N-phenylbutanimidothioate

There total 3 articles about ethyl N-phenylbutanimidothioate 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: 64.0%

: 18051-60-0
N-phenylthiobutyramide

: 75-03-6
ethyl iodide

: 19255-90-4
N-phenyl-butanimidothioic acid, ethyl ester

Guidance literature:: N-phenylthiobutyramide; With sodium ethanolate; In ethanol; at 20 ℃; for 1h;

ethyl iodide; In ethanol; at 60 ℃; for 9h;

Reference yield:

: 62-53-3
aniline

: 19255-90-4
N-phenyl-butanimidothioic acid, ethyl ester

Guidance literature:: Multi-step reaction with 3 steps

1.1: triethylamine / tetrahydrofuran / 2 h / 20 °C / Cooling with ice

2.1: Lawessons reagent / toluene / 2 h / 110 °C

3.1: sodium ethanolate / ethanol / 1 h / 20 °C

3.2: 9 h / 60 °C

With Lawessons reagent; sodium ethanolate; triethylamine; In tetrahydrofuran; ethanol; toluene;

Reference yield:

: 1129-50-6
N-phenylbutyramide

: 19255-90-4
N-phenyl-butanimidothioic acid, ethyl ester

Guidance literature:: Multi-step reaction with 2 steps

1.1: Lawessons reagent / toluene / 2 h / 110 °C

2.1: sodium ethanolate / ethanol / 1 h / 20 °C

2.2: 9 h / 60 °C

With Lawessons reagent; sodium ethanolate; In ethanol; toluene;