5-(4-Methylbenzylidene)-2-thioxodihydropyrimidine-4,6(1h,5h)-dione

Base Information

Chemical Name:5-(4-Methylbenzylidene)-2-thioxodihydropyrimidine-4,6(1h,5h)-dione
CAS No.:60045-62-7
Molecular Formula:C12H10N2O2S
Molecular Weight:246.29
Hs Code.:
NSC Number:90752
DSSTox Substance ID:DTXSID80975469
Nikkaji Number:J2.127.325B

Synonyms:60045-62-7;5-(4-methylbenzylidene)-2-thioxodihydropyrimidine-4,6(1h,5h)-dione;4,6(1H,5H)-Pyrimidinedione, dihydro-5-[(4-methylphenyl)methylene]-2-thioxo-;NSC90752;NCIOpen2_006289;DTXSID80975469;NSC-90752;STK732215;STK845936;AKOS001489375;AKOS005626202;2-Thioxo-5-(4-methylbenzylidene)hexahydropyrimidine-4,6-dione;(5Z)-6-hydroxy-5-(4-methylbenzylidene)-2-sulfanylpyrimidin-4(5H)-one;4,6-Dihydroxy-5-[(4-methylphenyl)methylidene]pyrimidine-2(5H)-thione

Suppliers and Price of 5-(4-Methylbenzylidene)-2-thioxodihydropyrimidine-4,6(1h,5h)-dione

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 5-(4-Methylbenzylidene)-2-thioxodihydropyrimidine-4,6(1h,5h)-dione

Chemical Property:

Density:1.38g/cm³
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:246.04629874
Heavy Atom Count:17
Complexity:373

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(C=C1)C=C2C(=O)NC(=S)NC2=O

Technology Process of 5-(4-Methylbenzylidene)-2-thioxodihydropyrimidine-4,6(1h,5h)-dione

There total 2 articles about 5-(4-Methylbenzylidene)-2-thioxodihydropyrimidine-4,6(1h,5h)-dione 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: 97.0%

: 504-17-6,157796-99-1,924832-30-4
4,6-dihydroxy-2-mercaptopyrimidine

: 104-87-0
4-methyl-benzaldehyde

: 60045-62-7
5-(4-methylbenzylidene)-2-thioxo-2,3-dihydro-(1H,5H)-pyrimidine-4,6-dione

Guidance literature:: With ethylammonium nitrate; at 20 ℃; for 0.166667h;
DOI:10.1081/SCC-200043210

Reference yield:

: 60045-62-7
5-(4-methylbenzylidene)-2-thioxo-2,3-dihydro-(1H,5H)-pyrimidine-4,6-dione

Guidance literature:: 2-Thiobarbitursaeure (I), p-CH3-C6H4-CHO;

Reference yield: 74.0%

: 100-44-7
benzyl chloride

: 60045-62-7
5-(4-methylbenzylidene)-2-thioxo-2,3-dihydro-(1H,5H)-pyrimidine-4,6-dione

: 1240506-94-8
(5Z)-2-(benzylthio)-5-(4-methylbenzylidene)pyrimidine-4,6(1H,5H)-dione

Guidance literature:: 5-(4-methylbenzylidene)-2-thioxo-2,3-dihydro-(1H,5H)-pyrimidine-4,6-dione; With Aliquat 336; In acetonitrile; at 50 ℃; for 0.5h;

benzyl chloride; In acetonitrile; at 50 ℃; for 2h;
DOI:10.1134/S1070363209100302