N-(4-ethylphenyl)-3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxamide

Base Information

Chemical Name:N-(4-ethylphenyl)-3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxamide
CAS No.:7066-30-0
Molecular Formula:C17H11 N3 O2
Molecular Weight:289.293
Hs Code.:
DSSTox Substance ID:DTXSID40990895
Wikidata:Q82980537

Synonyms:7066-30-0;DTXSID40990895;AKOS002781427;N-(4-Ethylphenyl)-3,6,6-trimethyl-4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboximidic acid

Suppliers and Price of N-(4-ethylphenyl)-3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxamide

Supply Marketing:

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

Manufacturers and distributors:

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Total 1 raw suppliers

Chemical Property of N-(4-ethylphenyl)-3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxamide

Chemical Property:

Vapor Pressure:1.96E-07mmHg at 25°C
Boiling Point:425.1°Cat760mmHg
Flash Point:210.9°C
Density:1.154g/cm³
XLogP3:4.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:325.16779360
Heavy Atom Count:24
Complexity:493

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC1=CC=C(C=C1)NC(=O)C2=C(C3=C(O2)CC(CC3=O)(C)C)C

Technology Process of N-(4-ethylphenyl)-3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxamide

There total 5 articles about N-(4-ethylphenyl)-3,6,6-trimethyl-4-oxo-5,7-dihydro-1-benzofuran-2-carboxamide 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: 65.0%

: 2-benzyl-3-hydroxy-2,3-dihydro-1H-pyrrolo[3,4-b]quinoxalin-1-one

: 7066-30-0
2-benzyl-1H-pyrrolo[3,4-b]quinoxaline-1,3(2H)-dione

Guidance literature:: With Jones reagent; In acetone; at 20 ℃; for 1h;
DOI:10.1016/j.tet.2018.11.023

Reference yield:

: 112369-35-4
3-Methyl-quinoxaline-2-carboxylic acid benzylamide

: 7066-30-0
2-benzyl-1H-pyrrolo[3,4-b]quinoxaline-1,3(2H)-dione

Guidance literature:: Multi-step reaction with 2 steps

1: copper(l) iodide; potassium peroxymonosulfate sulfate / dimethyl sulfoxide / 1.5 h / 80 °C

2: Jones reagent / acetone / 1 h / 20 °C

With copper(l) iodide; Jones reagent; potassium peroxymonosulfate sulfate; In dimethyl sulfoxide; acetone;
DOI:10.1016/j.tet.2018.11.023

Reference yield:

: 95-54-5
1,2-diamino-benzene

: 7066-30-0
2-benzyl-1H-pyrrolo[3,4-b]quinoxaline-1,3(2H)-dione

Guidance literature:: Multi-step reaction with 3 steps

1.1: bis-[(trifluoroacetoxy)iodo]benzene / acetonitrile; water / 40 °C

1.2: 2 h / 40 °C

2.1: copper(l) iodide; potassium peroxymonosulfate sulfate / dimethyl sulfoxide / 1.5 h / 80 °C

3.1: Jones reagent / acetone / 1 h / 20 °C

With copper(l) iodide; Jones reagent; potassium peroxymonosulfate sulfate; bis-[(trifluoroacetoxy)iodo]benzene; In water; dimethyl sulfoxide; acetone; acetonitrile;
DOI:10.1016/j.tet.2018.11.023