Coumarin, 3-thiocyano-4-methyl-7-(N,N-diethylamino)-

Base Information

Chemical Name:Coumarin, 3-thiocyano-4-methyl-7-(N,N-diethylamino)-
CAS No.:114171-77-6
Molecular Formula:C₁₅H₁₆N₂O₂S
Molecular Weight:288.37
Hs Code.:
DSSTox Substance ID:DTXSID30150663
Wikidata:Q83016826
Mol file:114171-77-6.mol

Synonyms:114171-77-6;Coumarin, 3-thiocyano-4-methyl-7-(N,N-diethylamino)-;[7-(diethylamino)-4-methyl-2-oxochromen-3-yl] thiocyanate;7-DIETHYLAMINO-4-METHYL-3-THIOCYANATO-CHROMEN-2-ONE;DTXSID30150663;STK331480;AKOS005438483;3-thiocyanato-4-methyl-7-diethylaminocoumarin;7-(diethylamino)-4-methyl-2-oxo-2H-chromen-3-yl thiocyanate;Thiocyanic acid,7-(diethylamino)-4-methyl-2-oxo-2H-1-benzopyran-3-ylester

Suppliers and Price of Coumarin, 3-thiocyano-4-methyl-7-(N,N-diethylamino)-

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 5 raw suppliers

Chemical Property of Coumarin, 3-thiocyano-4-methyl-7-(N,N-diethylamino)-

Chemical Property:

Vapor Pressure:4.06E-10mmHg at 25°C
Melting Point:128.5 °C
Boiling Point:499.7°Cat760mmHg
PKA:2.72±0.20(Predicted)
Flash Point:256°C
PSA：82.54000
Density:1.26g/cm³
LogP:3.52078
XLogP3:3.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:4
Exact Mass:288.09324893
Heavy Atom Count:20
Complexity:462

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCN(CC)C1=CC2=C(C=C1)C(=C(C(=O)O2)SC#N)C

Technology Process of Coumarin, 3-thiocyano-4-methyl-7-(N,N-diethylamino)-

There total 1 articles about Coumarin, 3-thiocyano-4-methyl-7-(N,N-diethylamino)- 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: 67.0%