Methyl 4-((4-ethylphenyl)amino)-6-methyl-2-oxo-3-cyclohexene-1-carboxylate

Base Information

Chemical Name:Methyl 4-((4-ethylphenyl)amino)-6-methyl-2-oxo-3-cyclohexene-1-carboxylate
CAS No.:142458-15-9
Molecular Formula:C₁₇H₂₁NO₃
Molecular Weight:287.359
Hs Code.:
DSSTox Substance ID:DTXSID40931465
Nikkaji Number:J504.415D
ChEMBL ID:CHEMBL301682

Synonyms:BRN 5441426;Methyl 4-((4-ethylphenyl)amino)-6-methyl-2-oxo-3-cyclohexene-1-carboxylate;3-Cyclohexene-1-carboxylic acid, 4-((4-ethylphenyl)amino)-6-methyl-2-oxo-, methyl ester;142458-15-9;CHEMBL301682;DTXSID40931465;methyl 4-(4-ethylanilino)-6-methyl-2-oxocyclohex-3-ene-1-carboxylate;LS-57442;6-Methyl-4-(p-ethylanilino)-2-oxo-3-cyclohexene-1-carboxylic acid methyl ester

Suppliers and Price of Methyl 4-((4-ethylphenyl)amino)-6-methyl-2-oxo-3-cyclohexene-1-carboxylate

Supply Marketing:

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

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Chemical Property of Methyl 4-((4-ethylphenyl)amino)-6-methyl-2-oxo-3-cyclohexene-1-carboxylate

Chemical Property:

Vapor Pressure:5.57E-07mmHg at 25°C
Boiling Point:411.5°Cat760mmHg
Flash Point:202.7°C
Density:1.151g/cm³
XLogP3:3.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:287.15214353
Heavy Atom Count:21
Complexity:422

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC1=CC=C(C=C1)NC2=CC(=O)C(C(C2)C)C(=O)OC

Technology Process of Methyl 4-((4-ethylphenyl)amino)-6-methyl-2-oxo-3-cyclohexene-1-carboxylate

There total 3 articles about Methyl 4-((4-ethylphenyl)amino)-6-methyl-2-oxo-3-cyclohexene-1-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: 43.0%

: 39493-30-6
methyl 2-hydroxy-6-methyl-4-oxocyclohex-2-enecarboxylate

: 589-16-2
4-aminoethylbenzene

: 142458-15-9
methyl 4-[(p-ethylphenyl)amino]-6-methyl-2-oxo-3-cyclohexen-1-carboxylate

Guidance literature:: In diethyl ether; ethyl acetate; for 4h; Heating;
DOI:10.1021/jm00093a012

Reference yield: 43.0%

: 56157-27-8
methyl 6-methyl-2,4-cyclohexanedione-1-carboxylate

: 589-16-2
4-aminoethylbenzene

: 142458-15-9
methyl 4-[(p-ethylphenyl)amino]-6-methyl-2-oxo-3-cyclohexen-1-carboxylate

Guidance literature:: In ethanol; for 4h; Heating;
DOI:10.1021/jm00066a003

Reference yield:

: 625-33-2
3-penten-2-one

: 142458-15-9
methyl 4-[(p-ethylphenyl)amino]-6-methyl-2-oxo-3-cyclohexen-1-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) sodium methanolate / 1.) 0 deg C, 30 min, 2.) a) 0 deg C, 1 h, b) reflux, 2 h

2: 43 percent / ethyl acetate; diethyl ether / 4 h / Heating

With sodium methylate; In diethyl ether; ethyl acetate;
DOI:10.1021/jm00093a012