2-Nitro-N-(1-chloro-2,2,2-trifluoroethylidene)aniline

Base Information

Chemical Name:2-Nitro-N-(1-chloro-2,2,2-trifluoroethylidene)aniline
CAS No.:1004972-86-4
Molecular Formula:C₈H₄ClF₃N₂O₂
Molecular Weight:252.58
Hs Code.:
DSSTox Substance ID:DTXSID301188090
Nikkaji Number:J1.199.809G

Synonyms:DTXSID301188090;2-Nitro-N-(1-chloro-2,2,2-trifluoroethylidene)aniline;(1Z)-2,2,2-Trifluoro-N-(2-nitrophenyl)ethanimidoyl chloride;1004972-86-4

Suppliers and Price of 2-Nitro-N-(1-chloro-2,2,2-trifluoroethylidene)aniline

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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 2-Nitro-N-(1-chloro-2,2,2-trifluoroethylidene)aniline

Chemical Property:

XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:1
Exact Mass:251.9913396
Heavy Atom Count:16
Complexity:301

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

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

Technology Process of 2-Nitro-N-(1-chloro-2,2,2-trifluoroethylidene)aniline

There total 1 articles about 2-Nitro-N-(1-chloro-2,2,2-trifluoroethylidene)aniline 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: 60.0%

: 88-74-4
2-nitro-aniline

: 76-05-1
trifluoroacetic acid

: 1004972-86-4
(Z)-2,2,2-trifluoro-N-(2-nitrophenyl)acetimidoyl chloride

Guidance literature:: trifluoroacetic acid; With triethylamine; triphenylphosphine; In tetrachloromethane; at 0 ℃; for 0.25h;

2-nitro-aniline; With tetrachloromethane; for 3h; Further stages.; Heating;
DOI:10.1039/b715810f

Reference yield:

: 927895-19-0
2-cyanopentanoic acid tert-butyl ester

: 1004972-86-4
(Z)-2,2,2-trifluoro-N-(2-nitrophenyl)acetimidoyl chloride

: 1004973-45-8
(S)-tert-butyl 2-cyano-2-(2,2,2-trifluoro-1-(2-nitrophenylamino)ethyl)pentanoate

Guidance literature:: 2-cyanopentanoic acid tert-butyl ester; (Z)-2,2,2-trifluoro-N-(2-nitrophenyl)acetimidoyl chloride; With potassium hydroxide; In chloroform; o-xylene; at -20 ℃; for 18h;

With sodium tetrahydroborate; lithium perchlorate; In ethanol; at -78 - 20 ℃; Further stages.;
DOI:10.1039/b715810f

Reference yield:

: 1004972-86-4
(Z)-2,2,2-trifluoro-N-(2-nitrophenyl)acetimidoyl chloride

: 1004973-05-0
tert-butyl 7-(tert-butyldimethylsilyloxy)-2-cyanoheptanoate

: 1004973-29-8
(S,Z)-tert-butyl 7-(tert-butyldimethylsilyloxy)-2-cyano-2-(2,2,2-trifluoro-1-(2-nitrophenylimino)ethyl)heptanoate

: (R,Z)-tert-butyl 7-(tert-butyldimethylsilyloxy)-2-cyano-2-(2,2,2-trifluoro-1-(2-nitrophenylimino)ethyl)heptanoate

Guidance literature:: With potassium hydroxide; In chloroform; o-xylene; at -20 ℃; for 16h; Title compound not separated from byproducts.;
DOI:10.1039/b715810f