5-[(4-Methylphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one

Base Information

Chemical Name:5-[(4-Methylphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one
CAS No.:63204-30-8
Molecular Formula:C12H12N2OS
Molecular Weight:232.306
Hs Code.:
NSC Number:79700
DSSTox Substance ID:DTXSID50398106
Nikkaji Number:J696.880E

Synonyms:63204-30-8;5-(4-Methylbenzyl)-2-thiouracil;5-[4-Methylbenzyl]-2-thiouracil;NSC79700;SCHEMBL11450005;DTXSID50398106;IJZRZKLMMNHAJC-UHFFFAOYSA-N;NSC-79700;5-[(4-Methylphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one

Suppliers and Price of 5-[(4-Methylphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one

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 6 raw suppliers

Chemical Property of 5-[(4-Methylphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
Density:1.28g/cm³
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:232.06703418
Heavy Atom Count:16
Complexity:330

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)CC2=CNC(=S)NC2=O

Technology Process of 5-[(4-Methylphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one

There total 8 articles about 5-[(4-Methylphenyl)methyl]-2-sulfanylidene-2,3-dihydropyrimidin-4(1H)-one 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:

: 97585-04-1,20511-20-0,24393-49-5
ethyl (E)-3-(4-methylphenyl)acrylate

: 63204-30-8
5-(4-methyl-benzyl)-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one

Guidance literature:: Multi-step reaction with 3 steps

1: hydrogen / 5percent Pd/C / ethanol

2: sodium wire / diethyl ether / 18 h / Ambient temperature

3: ethanol / 7 h / Heating

With hydrogen; sodium; palladium on activated charcoal; In diethyl ether; ethanol;
DOI:10.1016/0223-5234(88)90167-5

Reference yield:

: 20511-20-0
ethyl p-methylcinnamate

: 63204-30-8
5-(4-methyl-benzyl)-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one

Guidance literature:: Multi-step reaction with 2 steps

1: H₂ / PtO₂ / ethanol

2: 1.) Na, 3.) conc. HCl

With hydrogenchloride; hydrogen; sodium; platinum(IV) oxide; In ethanol;
DOI:10.1021/jm00019a015

Reference yield:

: 1866-39-3,940-61-4
4-methylcinnamic acid

: 63204-30-8
5-(4-methyl-benzyl)-2-thioxo-2,3-dihydro-1H-pyrimidin-4-one

Guidance literature:: Multi-step reaction with 3 steps

1: HCl / diethyl ether / Heating

2: H₂ / PtO₂ / ethanol

3: 1.) Na, 3.) conc. HCl

With hydrogenchloride; hydrogen; sodium; platinum(IV) oxide; In diethyl ether; ethanol;
DOI:10.1021/jm00019a015