1,3-Diethyl 2-[[[2-(methylthio)phenyl]amino]methylene]propanedioate

Base Information

Chemical Name:1,3-Diethyl 2-[[[2-(methylthio)phenyl]amino]methylene]propanedioate
CAS No.:104007-13-8
Molecular Formula:C₁₅H₁₉NO₄S
Molecular Weight:309.386
Hs Code.:
DSSTox Substance ID:DTXSID401162205
Mol file:104007-13-8.mol

Synonyms:SCHEMBL10862488;DTXSID401162205;1,3-Diethyl 2-[[[2-(methylthio)phenyl]amino]methylene]propanedioate;104007-13-8

Suppliers and Price of 1,3-Diethyl 2-[[[2-(methylthio)phenyl]amino]methylene]propanedioate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 1,3-Diethyl 2-[[[2-(methylthio)phenyl]amino]methylene]propanedioate

Chemical Property:

XLogP3:3.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:9
Exact Mass:309.10347926
Heavy Atom Count:21
Complexity:364

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C(=CNC1=CC=CC=C1SC)C(=O)OCC

Technology Process of 1,3-Diethyl 2-[[[2-(methylthio)phenyl]amino]methylene]propanedioate

There total 1 articles about 1,3-Diethyl 2-[[[2-(methylthio)phenyl]amino]methylene]propanedioate 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:

: 2987-53-3
2-(Methylthio)aniline

: 87-13-8
diethyl 2-ethoxymethylenemalonate

: 104007-13-8
2-[(2-methylsulfanyl-phenylamino)-methylene]-malonic acid diethyl ester

Guidance literature:: In toluene; Heating;
DOI:10.1016/j.bmcl.2005.04.040

Reference yield:

: 104007-13-8
2-[(2-methylsulfanyl-phenylamino)-methylene]-malonic acid diethyl ester

: 4-hydroxy-8-methylsulfanyl-quinoline-3-carboxylic acid methyl-phenyl-amide

Guidance literature:: Multi-step reaction with 2 steps

1: diphenyl ether / 250 °C

2: diphenyl ether / 210 °C

In diphenylether;
DOI:10.1016/j.bmcl.2005.04.040