Benzoic acid, 4-nitro-2-[(trifluoroacetyl)amino]-

Base Information

Chemical Name:Benzoic acid, 4-nitro-2-[(trifluoroacetyl)amino]-
CAS No.:91533-09-4
Molecular Formula:C9H5F3N2O5
Molecular Weight:278.144
Hs Code.:
DSSTox Substance ID:DTXSID50345574
Wikidata:Q82118146

Synonyms:Benzoic acid, 4-nitro-2-[(trifluoroacetyl)amino]-;91533-09-4;4-nitro-2-trifluoro-acetamido-benzoic acid;SCHEMBL8553107;DTXSID50345574;AKOS012411928;4-nitro-2-trifluoroacetamido-benzoic acid;4-nitro-N-trifluoroacetyl-anthranilic acid;4-nitro-2-(trifluoroacetamido)benzoic acid;4-Nitro-2-[(trifluoroacetyl)amino]benzoic acid #;EN300-12405489

Suppliers and Price of Benzoic acid, 4-nitro-2-[(trifluoroacetyl)amino]-

Supply Marketing:

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

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Chemical Property of Benzoic acid, 4-nitro-2-[(trifluoroacetyl)amino]-

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:2
Exact Mass:278.01505575
Heavy Atom Count:19
Complexity:392

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1[N+](=O)[O-])NC(=O)C(F)(F)F)C(=O)O

Technology Process of Benzoic acid, 4-nitro-2-[(trifluoroacetyl)amino]-

There total 1 articles about Benzoic acid, 4-nitro-2-[(trifluoroacetyl)amino]- 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:

: 619-17-0
4-Nitroanthranilic acid

: 91533-09-4
4-nitro-2-trifluoro-acetamido-benzoic acid

Guidance literature:: With trifluoroacetic anhydride; In 1,4-dioxane;

Reference yield:

: 91533-09-4
4-nitro-2-trifluoro-acetamido-benzoic acid

: 4-amino-N-trifluoroacetyl-anthranilic acid

Guidance literature:: palladium-carbon catalyst; In ethanol; hydrogen;

Reference yield:

: 91533-09-4
4-nitro-2-trifluoro-acetamido-benzoic acid

: 129175-80-0
(S)-2-[4-Amino-2-(2,2,2-trifluoro-acetylamino)-benzoylamino]-pentanedioic acid diethyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: oxalyl chloride, DMF / CH₂Cl₂ / 3 h

2: Et₃N / CH₂Cl₂ / 1 h

3: H₂ / 10percent Pd/C / ethyl acetate / 4 h / 760 Torr

With oxalyl dichloride; hydrogen; triethylamine; N,N-dimethyl-formamide; palladium on activated charcoal; In dichloromethane; ethyl acetate;
DOI:10.1021/jm00173a026