1-Ethyl 4-[(carboxymethyl)(2,2,2-trifluoroacetyl)amino]benzoate

Base Information

Chemical Name:1-Ethyl 4-[(carboxymethyl)(2,2,2-trifluoroacetyl)amino]benzoate
CAS No.:574-02-7
Molecular Formula:C₁₃H₁₂F₃NO₅
Molecular Weight:319.237
Hs Code.:
DSSTox Substance ID:DTXSID201173422

Synonyms:DTXSID201173422;1-Ethyl 4-[(carboxymethyl)(2,2,2-trifluoroacetyl)amino]benzoate;574-02-7

Suppliers and Price of 1-Ethyl 4-[(carboxymethyl)(2,2,2-trifluoroacetyl)amino]benzoate

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 0 raw suppliers

Chemical Property of 1-Ethyl 4-[(carboxymethyl)(2,2,2-trifluoroacetyl)amino]benzoate

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:6
Exact Mass:319.06675697
Heavy Atom Count:22
Complexity:430

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C1=CC=C(C=C1)N(CC(=O)O)C(=O)C(F)(F)F

Technology Process of 1-Ethyl 4-[(carboxymethyl)(2,2,2-trifluoroacetyl)amino]benzoate

There total 2 articles about 1-Ethyl 4-[(carboxymethyl)(2,2,2-trifluoroacetyl)amino]benzoate 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: 75.7%

: 59081-60-6
N-(4-ethoxycarbonylphenyl)aminoacetic acid

: 407-25-0
trifluoroacetic anhydride

: 574-02-7
N-(p-Carbethoxyphenyl)-N-(trifluoroacetyl)glycine

Guidance literature:: In dichloromethane; at 0 ℃; for 2h;
DOI:10.1021/jo00328a042

Reference yield:

: 94-09-7
p-aminoethylbenzoate

: 574-02-7
N-(p-Carbethoxyphenyl)-N-(trifluoroacetyl)glycine

Guidance literature:: Multi-step reaction with 2 steps

1: 44.8 percent / 80 - 100 °C

2: 75.7 percent / CH₂Cl₂ / 2 h / 0 °C

In dichloromethane;
DOI:10.1021/jo00328a042