Benzyl 1-(3-chloro-4-fluoroanilino)-2,2,2-trifluoro-1-(trifluoromethyl)ethylcarbamate

Base Information

Chemical Name:Benzyl 1-(3-chloro-4-fluoroanilino)-2,2,2-trifluoro-1-(trifluoromethyl)ethylcarbamate
CAS No.:128229-97-0
Molecular Formula:C₁₇H₁₂ClF₇N₂O₂
Molecular Weight:444.736
Hs Code.:
NSC Number:672008
DSSTox Substance ID:DTXSID901107292
ChEMBL ID:CHEMBL1984988

Synonyms:NSC672008;Benzyl 1-(3-chloro-4-fluoroanilino)-2,2,2-trifluoro-1-(trifluoromethyl)ethylcarbamate;CHEMBL1984988;DTXSID901107292;NSC-672008;NCI60_025504;benzyl N-[1-(3-chloro-4-fluoro-anilino)-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]carbamate;128229-97-0;Carbamic acid, [1-[(3-chloro-4-fluorophenyl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]-, phenylmethyl ester

Suppliers and Price of Benzyl 1-(3-chloro-4-fluoroanilino)-2,2,2-trifluoro-1-(trifluoromethyl)ethylcarbamate

Supply Marketing:

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

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Chemical Property of Benzyl 1-(3-chloro-4-fluoroanilino)-2,2,2-trifluoro-1-(trifluoromethyl)ethylcarbamate

Chemical Property:

XLogP3:6.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:10
Rotatable Bond Count:6
Exact Mass:444.0475525
Heavy Atom Count:29
Complexity:539

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)COC(=O)NC(C(F)(F)F)(C(F)(F)F)NC2=CC(=C(C=C2)F)Cl

Technology Process of Benzyl 1-(3-chloro-4-fluoroanilino)-2,2,2-trifluoro-1-(trifluoromethyl)ethylcarbamate

There total 2 articles about Benzyl 1-(3-chloro-4-fluoroanilino)-2,2,2-trifluoro-1-(trifluoromethyl)ethylcarbamate 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: 95.0%

: 367-21-5
3-chloro-4-fluorophenylamine

: 128229-95-8
benzylhydroxycarbonylimine of hexafluoroacetone

: 128229-97-0
Benzyl N-<2-(4-fluoro-3-chloroanilino)hexafluoro-2-propyl>carbamate

Guidance literature:: In diethyl ether; at 20 - 30 ℃; for 10h;
DOI:10.1007/BF00960660

Reference yield:

: 100-51-6,185532-71-2
benzyl alcohol

: 128229-97-0
Benzyl N-<2-(4-fluoro-3-chloroanilino)hexafluoro-2-propyl>carbamate

Guidance literature:: Multi-step reaction with 2 steps

1: 67 percent / pyridine / diethyl ether / 20 °C

2: 95 percent / diethyl ether / 10 h / 20 - 30 °C

With pyridine; In diethyl ether;
DOI:10.1007/BF00960660