Propanethioamide, N-methyl-N-phenyl-

Base Information

Chemical Name:Propanethioamide, N-methyl-N-phenyl-
CAS No.:5310-08-7
Molecular Formula:C10H13 N S
Molecular Weight:0
Hs Code.:
DSSTox Substance ID:DTXSID40967623
Wikidata:Q82950227
Mol file:5310-08-7.mol

Synonyms:Propanethioamide, N-methyl-N-phenyl-;5310-08-7;CBMicro_016854;DTXSID40967623;CCG-5758;STK789002;AKOS000616387;BIM-0016768.P001;Dimethyl 2-[1-(3-fluorobenzoyl)-6-methoxy-2,2-dimethyl-3-sulfanylidene-2,3-dihydroquinolin-4(1H)-ylidene]-2H-1,3-dithiole-4,5-dicarboxylate;dimethyl 2-{1-[(3-fluorophenyl)carbonyl]-6-methoxy-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene}-1,3-dithiole-4,5-dicarboxylate

Suppliers and Price of Propanethioamide, N-methyl-N-phenyl-

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 3 raw suppliers

Chemical Property of Propanethioamide, N-methyl-N-phenyl-

Chemical Property:

Vapor Pressure:1.28E-17mmHg at 25°C
Boiling Point:666.3°Cat760mmHg
Flash Point:356.7°C
PSA：35.33000
Density:1.48g/cm³
LogP:2.86020
XLogP3:5.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:559.05932910
Heavy Atom Count:37
Complexity:1030

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=C(N1C(=O)C4=CC(=CC=C4)F)C=CC(=C3)OC)C

Technology Process of Propanethioamide, N-methyl-N-phenyl-

There total 4 articles about Propanethioamide, N-methyl-N-phenyl- 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: 78.0%

: 5827-78-1
N-methyl-N-phenylpropanamide

: 5310-08-7
N-methyl-N-phenylthiopropionamide

Guidance literature:: With Lawessons reagent; In toluene; at 100 - 110 ℃; for 3.33333h; Inert atmosphere;
DOI:10.1021/acs.joc.1c00801

Reference yield:

: 100-61-8
N-methylaniline

: 5310-08-7
N-methyl-N-phenylthiopropionamide

Guidance literature:: Multi-step reaction with 2 steps

1: triethylamine / dichloromethane / 4 h / 0 - 20 °C

2: Lawessons reagent / dichloromethane / 4 h / 20 °C

With Lawessons reagent; triethylamine; In dichloromethane;
DOI:10.1039/c9ob02125f