5-[[(2,4-Dimethoxyphenyl)amino](methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione

Base Information

Chemical Name:5-[[(2,4-Dimethoxyphenyl)amino](methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione
CAS No.:141993-72-8
Molecular Formula:C16H19NO6S
Molecular Weight:353.396
Hs Code.:
DSSTox Substance ID:DTXSID901123773

Synonyms:SCHEMBL9023144;DTXSID901123773;5-[[(2,4-Dimethoxyphenyl)amino](methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione;141993-72-8

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

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Chemical Property of 5-[[(2,4-Dimethoxyphenyl)amino](methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:353.09330850
Heavy Atom Count:24
Complexity:511

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1(OC(=O)C(=C(NC2=C(C=C(C=C2)OC)OC)SC)C(=O)O1)C

Technology Process of 5-[[(2,4-Dimethoxyphenyl)amino](methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione

There total 1 articles about 5-[[(2,4-Dimethoxyphenyl)amino](methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-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: 50.0%

: 100981-05-3
5-[bis(methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione

: 2735-04-8,161687-55-4
2,4-Dimethoxyaniline

: 141993-72-8
5-[(2,4-dimethoxyanilino)(methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione

Guidance literature:: In ethanol; for 10h; Heating;
DOI:10.1021/jo026275+

Reference yield: 90.0%

: 141993-72-8
5-[(2,4-dimethoxyanilino)(methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione

: 124-40-3
dimethyl amine

: 487009-58-5
5-[(2,4-dimethoxyanilino)(dimethylamino)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione

Guidance literature:: In tetrahydrofuran; at 90 ℃; for 6h; under 51716.2 Torr;
DOI:10.1021/jo026275+

Reference yield:

: 141993-72-8
5-[(2,4-dimethoxyanilino)(methylthio)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione

: 2,4-dimethoxyphenyliminopropadienone

Guidance literature:: Multi-step reaction with 2 steps

1: 90 percent / tetrahydrofuran / 6 h / 90 °C / 51716.2 Torr

2: 400 - 700 °C / flash vacuum thermolysis

In tetrahydrofuran;
DOI:10.1021/jo026275+