4-Fluoro-2-(methylsulfanyl)pyrimidine

Base Information

Chemical Name:4-Fluoro-2-(methylsulfanyl)pyrimidine
CAS No.:161124-03-4
Molecular Formula:C₅H₅FN₂S
Molecular Weight:144.173
Hs Code.:
European Community (EC) Number:967-234-1
Nikkaji Number:J1.461.819H
Mol file:161124-03-4.mol

Synonyms:161124-03-4;4-fluoro-2-methylsulfanyl-pyrimidine;Pyrimidine, 4-fluoro-2-(methylthio)- (9CI);4-Fluoro-2-(methylsulfanyl)pyrimidine;4-fluoro-2-methylsulfanylpyrimidine;4-fluoro-2-methylthiopyrimidine;SCHEMBL4771461;PTOVZQHGXMAESP-UHFFFAOYSA-N;4-Fluoro-2-(methylthio)pyrimidine;MFCD27945632;SB34031;Pyrimidine,4-fluoro-2-(methylthio)-(9ci);CS-0341844;EN300-299027;Z1862020309

Suppliers and Price of 4-Fluoro-2-(methylsulfanyl)pyrimidine

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

J&W Pharmlab
4-Fluoro-2-methylsulfanyl-pyrimidine 96%
5g
$ 3998.00

J&W Pharmlab
4-Fluoro-2-methylsulfanyl-pyrimidine 96%
1g
$ 998.00

J&W Pharmlab
4-Fluoro-2-methylsulfanyl-pyrimidine 96%
500mg
$ 549.00

J&W Pharmlab
4-Fluoro-2-methylsulfanyl-pyrimidine 96%
250mg
$ 325.00

J&W Pharmlab
4-Fluoro-2-methylsulfanyl-pyrimidine 96%
100mg
$ 212.00

J&W Pharmlab
4-Fluoro-2-methylsulfanyl-pyrimidine 96%
50mg
$ 156.00

Total 4 raw suppliers

Chemical Property of 4-Fluoro-2-(methylsulfanyl)pyrimidine

Chemical Property:

Boiling Point:221.0±13.0 °C(Predicted)
PKA:-0.18±0.20(Predicted)
PSA：51.08000
Density:1.30±0.1 g/cm3(Predicted)
LogP:1.33760
XLogP3:1.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:144.01574750
Heavy Atom Count:9
Complexity:91

Purity/Quality:

97% ^*data from raw suppliers

4-Fluoro-2-methylsulfanyl-pyrimidine 96% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CSC1=NC=CC(=N1)F

Technology Process of 4-Fluoro-2-(methylsulfanyl)pyrimidine

There total 1 articles about 4-Fluoro-2-(methylsulfanyl)pyrimidine 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: 70.0%

: 49844-90-8
4-Chloro-2-methylthiopyrimidine

: 161124-03-4
4-fluoro-2-methylsulfanylpyrimidine

Guidance literature:: With N,N,N',N'-tetramethyl-1,8-diaminonaphthalene; triethylamine tris(hydrogen fluoride); at 120 ℃; for 24h;
DOI:10.1016/S0040-4020(00)01060-7

Reference yield:

: 161124-03-4
4-fluoro-2-methylsulfanylpyrimidine

: 161124-11-4
2-thiomethyl-4-fluoro-5-(2-pivaloylaminophenyl)pyrimidine

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) butyllithium, diisopropylamine, 2.) I₂ / 1.) THF, -70 deg C, 1 h, 2.) THF, -70 deg C, 1 h

2: 82 percent / lithium chloride, bis(acetonitrile)palladiumII chloride / dioxane / 168 h / 90 °C

With dichloro bis(acetonitrile) palladium(II); n-butyllithium; iodine; diisopropylamine; lithium chloride; In 1,4-dioxane;
DOI:10.1002/jhet.5570310602

Reference yield:

: 135-02-4
ortho-anisaldehyde

: 161124-03-4
4-fluoro-2-methylsulfanylpyrimidine

: (2-thiomethyl-4-fluoro-5-pyrimidinyl)-2-methoxyphenylmethanol

Guidance literature:: With n-butyllithium; diisopropylamine; Yield given. Multistep reaction; 1.) THF, -70 deg C, 1 h, 2.) THF, -70 deg C, 1 h;
DOI:10.1002/jhet.5570310602