2(1H)-Pyrimidinethione, 3,4-dihydro-1-(o-nitrophenyl)-4,4,6-trimethyl-

Base Information

Chemical Name:2(1H)-Pyrimidinethione, 3,4-dihydro-1-(o-nitrophenyl)-4,4,6-trimethyl-
CAS No.:50403-73-1
Molecular Formula:C13H15N3O2S
Molecular Weight:277.34
Hs Code.:2933599090
DSSTox Substance ID:DTXSID20198458
Nikkaji Number:J87.001C
Wikidata:Q83071227
Mol file:50403-73-1.mol

Synonyms:USAF K-1351;50403-73-1;2(1H)-Pyrimidinethione, 3,4-dihydro-1-(o-nitrophenyl)-4,4,6-trimethyl-;AI3-24613;2(1H)-Pyrimidinethione, 3,4-dihydro-4,4,6-trimethyl-1-(2-nitrophenyl)-;1-(2-Nitrophenyl)-2-thio-4,4,6-trimethyl dihydropyrimidine;DTXSID20198458;LS-135622

Suppliers and Price of 2(1H)-Pyrimidinethione, 3,4-dihydro-1-(o-nitrophenyl)-4,4,6-trimethyl-

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 2(1H)-Pyrimidinethione, 3,4-dihydro-1-(o-nitrophenyl)-4,4,6-trimethyl-

Chemical Property:

Vapor Pressure:4.43E-06mmHg at 25°C
Boiling Point:383.3°C at 760 mmHg
Flash Point:185.6°C
PSA：100.22000
Density:1.31g/cm³
LogP:3.40680
XLogP3:2.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:277.08849790
Heavy Atom Count:19
Complexity:428

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(NC(=S)N1C2=CC=CC=C2[N+](=O)[O-])(C)C

Technology Process of 2(1H)-Pyrimidinethione, 3,4-dihydro-1-(o-nitrophenyl)-4,4,6-trimethyl-

There total 2 articles about 2(1H)-Pyrimidinethione, 3,4-dihydro-1-(o-nitrophenyl)-4,4,6-trimethyl- 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: 80.0%

: 141-79-7
4-methyl-pent-3-en-2-one

: 1147550-11-5
ammonium thiocyanate

: 88-74-4
2-nitro-aniline

: 50403-73-1
4,4,6-trimethyl-1-(2-nitrophenyl)-1,4-dihydropyrimidine-2(3H)-thione

Guidance literature:: With hydrogenchloride; In water; 1.) 25 deg C, 0.5 h, 2.) reflux, 3 h;
DOI:10.1055/s-1982-30073

Reference yield:

: 50403-73-1
1,4-Dihydro-4,4,6-trimethyl-1-(2-nitrophenyl)-pyrimidine-2-thiol

Guidance literature:: 2-Nitroanilin, 2-Methyl-2-isothio-ciano-4-pentanon;

Reference yield: 94.0%

: 50403-73-1
4,4,6-trimethyl-1-(2-nitrophenyl)-1,4-dihydropyrimidine-2(3H)-thione

: 74-88-4
methyl iodide

: 85311-48-4
4,4,6-Trimethyl-2-methylsulfanyl-1-(2-nitro-phenyl)-1,4-dihydro-pyrimidine

Guidance literature:: With sodium hydroxide; tetra(n-butyl)ammonium hydrogensulfate; In benzene; for 2h; Ambient temperature;
DOI:10.1055/s-1982-30073