Ethyl 6-chloro-3-(methylthio)-1,2,4-triazine-5-carboxylate

Base Information

Chemical Name:Ethyl 6-chloro-3-(methylthio)-1,2,4-triazine-5-carboxylate
CAS No.:96259-28-8
Molecular Formula:C₇H₈ClN₃O₂S
Molecular Weight:233.678
Hs Code.:2933699090
DSSTox Substance ID:DTXSID401192115
Mol file:96259-28-8.mol

Synonyms:ETHYL 6-CHLORO-3-(METHYLTHIO)-1,2,4-TRIAZINE-5-CARBOXYLATE;96259-28-8;6-chloro-3-methylsulfanyl-[1,2,4]triazine-5-carboxylic acid ethyl ester;DTXSID401192115;AB55546;ethyl 6-chloro-3-methylsulfanyl-1,2,4-triazine-5-carboxylate

Suppliers and Price of Ethyl 6-chloro-3-(methylthio)-1,2,4-triazine-5-carboxylate

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

American Custom Chemicals Corporation
ETHYL-6-CHLORO-3-(METHYLTHIO)-1,2,4-TRIAZINE-5-CARBOXYLATE 95.00%
5MG
$ 496.02

Total 4 raw suppliers

Chemical Property of Ethyl 6-chloro-3-(methylthio)-1,2,4-triazine-5-carboxylate

Chemical Property:

PSA：90.27000
LogP:1.42360
XLogP3:1.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:233.0025754
Heavy Atom Count:14
Complexity:207

Purity/Quality:

98%min ^*data from raw suppliers

ETHYL-6-CHLORO-3-(METHYLTHIO)-1,2,4-TRIAZINE-5-CARBOXYLATE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1=C(N=NC(=N1)SC)Cl

Technology Process of Ethyl 6-chloro-3-(methylthio)-1,2,4-triazine-5-carboxylate

There total 2 articles about Ethyl 6-chloro-3-(methylthio)-1,2,4-triazine-5-carboxylate 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: 92.0%

: 96259-27-7
3-(methylthio)-5-carbethoxy-6-oxo-1,6-dihydro-1,2,4-triazine

: 96259-28-8
3-(methylthio)-5-carbethoxy-6-chloro-1,2,4-triazine

Guidance literature:: With sulfuric acid; trichlorophosphate; for 4h; Heating;
DOI:10.1021/jo00213a019

Reference yield:

: 609-09-6
Diethyl ketomalonate

: 96259-28-8
3-(methylthio)-5-carbethoxy-6-chloro-1,2,4-triazine

Guidance literature:: Multi-step reaction with 2 steps

1: 33 percent / aq. NaHCO₃

2: 92 percent / POCl₃, conc. H₂SO₄ / 4 h / Heating

With sulfuric acid; sodium hydrogencarbonate; trichlorophosphate;
DOI:10.1021/jo00213a019