4-[(2-Ethylphenyl)amino]-4-oxo-2-butenoic acid

Base Information

Chemical Name:4-[(2-Ethylphenyl)amino]-4-oxo-2-butenoic acid
CAS No.:300559-68-6
Molecular Formula:C₁₂H₁₃NO₃
Molecular Weight:219.24
Hs Code.:
DSSTox Substance ID:DTXSID101246648

Synonyms:4-[(2-ethylphenyl)amino]-4-oxo-2-butenoic acid;CBDivE_013527;DTXSID101246648;300559-68-6

Suppliers and Price of 4-[(2-Ethylphenyl)amino]-4-oxo-2-butenoic acid

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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 4-[(2-Ethylphenyl)amino]-4-oxo-2-butenoic acid

Chemical Property:

XLogP3:1.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:219.08954328
Heavy Atom Count:16
Complexity:286

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCC1=CC=CC=C1NC(=O)C=CC(=O)O

Technology Process of 4-[(2-Ethylphenyl)amino]-4-oxo-2-butenoic acid

There total 1 articles about 4-[(2-Ethylphenyl)amino]-4-oxo-2-butenoic acid 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:

: 108-31-6
maleic anhydride

: 578-54-1
ortho-ethylaniline

: 300559-68-6
3-(2-ethylanilinocarbonyl)propenoic acid

Guidance literature:: With acetic acid;
DOI:10.1134/S1070363213120396

Reference yield:

: 300559-68-6
3-(2-ethylanilinocarbonyl)propenoic acid

: 91569-16-3
1-(2-ethylphenyl)maleimide

Guidance literature:: With sodium acetate; acetic anhydride; at 80 ℃; for 1h;
DOI:10.1039/c8nj00476e

Reference yield:

: 300559-68-6
3-(2-ethylanilinocarbonyl)propenoic acid

: 357932-93-5
C₂₈H₂₀ClNO₅

Guidance literature:: Multi-step reaction with 2 steps

1: sodium acetate / acetic anhydride / 0.5 h / 120 °C / Microwave irradiation

2: dirhodium tetraacetate / 1,2-dichloro-ethane / 80 °C / Molecular sieve; Inert atmosphere

With dirhodium tetraacetate; sodium acetate; In acetic anhydride; 1,2-dichloro-ethane;
DOI:10.1016/j.ejmech.2020.112115