5-(3-chlorobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione

Base Information

Chemical Name:5-(3-chlorobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione
CAS No.:71732-11-1
Molecular Formula:C11H7 Cl N2 O3
Molecular Weight:250.641
Hs Code.:
NSC Number:636610,95881
DSSTox Substance ID:DTXSID30294339
Nikkaji Number:J562.251D

Synonyms:71732-11-1;NSC636610;5-(3-chlorobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione;NSC95881;CBMicro_032704;NCIOpen2_006141;SCHEMBL16543015;DTXSID30294339;NSC-95881;STK213410;AKOS003664229;NSC-636610;BIM-0032944.P001;5-(3-Chlorobenzylidene)-2,4,6(1H,3H,5H)-pyrimidinetrione;5-[(3-chlorophenyl)methylene]hexahydropyrimidine-2,4,6-trione

Suppliers and Price of 5-(3-chlorobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione

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
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price

Total 5 raw suppliers

Chemical Property of 5-(3-chlorobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione

Chemical Property:

Density:1.494g/cm³
XLogP3:1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:250.0145198
Heavy Atom Count:17
Complexity:384

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)Cl)C=C2C(=O)NC(=O)NC2=O

Technology Process of 5-(3-chlorobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione

There total 1 articles about 5-(3-chlorobenzylidene)pyrimidine-2,4,6(1H,3H,5H)-trione 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: 95.0%

: 67-52-7,944357-77-1
BARBITURIC ACID

: 587-04-2
m-Chlorobenzaldehyde

: 71732-11-1
5-(3-chlorobenzylidene)-2, 4, 6(1H, 3H, 5H)-pyrimidinetrione

Guidance literature:: With ammonium chloride; In water; at 20 ℃; for 0.5h;
DOI:10.2174/157017811794557778

Reference yield: 76.0%

: 71732-11-1
5-(3-chlorobenzylidene)-2, 4, 6(1H, 3H, 5H)-pyrimidinetrione

: 104823-32-7
5-(m-chloro)benzylbarbituric acid

Guidance literature:: With sodium tetrahydroborate; In ethanol; for 2h;

Reference yield:

: 71732-11-1
5-(3-chlorobenzylidene)-2, 4, 6(1H, 3H, 5H)-pyrimidinetrione

: 5-<1-(3-chlorophenyl)-2-phenylethyl>-2,4,6-trichloropyrimidine

Guidance literature:: Multi-step reaction with 2 steps

1: 2.) conc. aq. HCl / 1.) THF, RT, 1 h

2: 1.) POCl₃, 2.) PCl₅ / 1.) 105 deg C, overnight, 2.) reflux, overnight

With hydrogenchloride; phosphorus pentachloride; trichlorophosphate;
DOI:10.1016/0223-5234(96)88279-1