ethyl N-[6-amino-4-[[(2E)-2-hydroxyimino-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-5-nitro-2-pyridyl]carbamate

Base Information

Chemical Name:ethyl N-[6-amino-4-[[(2E)-2-hydroxyimino-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-5-nitro-2-pyridyl]carbamate
CAS No.:82585-71-5
Molecular Formula:C17H17F3N6O5
Molecular Weight:442.3493
Hs Code.:
NSC Number:335415

Synonyms:NSC335415;82585-71-5;NSC-335415;Carbamic acid,6-amino-5-nitro-4-[[2-[4'- (trifluoromethyl)phenyl]-2-oxo-ethyl]amino]pyridin-2-yl, ethyl ester,oxime;ethyl N-[6-amino-4-[[(2E)-2-hydroxyimino-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-5-nitro-2-pyridyl]carbamate

Suppliers and Price of ethyl N-[6-amino-4-[[(2E)-2-hydroxyimino-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-5-nitro-2-pyridyl]carbamate

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
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price

Total 3 raw suppliers

Chemical Property of ethyl N-[6-amino-4-[[(2E)-2-hydroxyimino-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-5-nitro-2-pyridyl]carbamate

Chemical Property:

Vapor Pressure:1.9E-15mmHg at 25°C
Boiling Point:604.2°Cat760mmHg
Flash Point:319.2°C
Density:1.55g/cm³
XLogP3:4.3
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:12
Rotatable Bond Count:7
Exact Mass:442.12125215
Heavy Atom Count:31
Complexity:651

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)NC1=NC(=C(C(=C1)NCC(=NO)C2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-])N
Isomeric SMILES:CCOC(=O)NC1=NC(=C(C(=C1)NC/C(=N/O)/C2=CC=C(C=C2)C(F)(F)F)[N+](=O)[O-])N

Technology Process of ethyl N-[6-amino-4-[[(2E)-2-hydroxyimino-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-5-nitro-2-pyridyl]carbamate

There total 2 articles about ethyl N-[6-amino-4-[[(2E)-2-hydroxyimino-2-[4-(trifluoromethyl)phenyl]ethyl]amino]-5-nitro-2-pyridyl]carbamate 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: 47.0%

: 6506-86-1
ethyl (6-amino-4-chloro-5-nitropyridin-2-yl)carbamate

: 82585-42-0
2-Amino-1-(4-trifluoromethyl-phenyl)-ethanone oxime

: 82585-71-5
{6-Amino-4-[2-[(Z)-hydroxyimino]-2-(4-trifluoromethyl-phenyl)-ethylamino]-5-nitro-pyridin-2-yl}-carbamic acid ethyl ester

Guidance literature:: With triethylamine; In ethanol; at 75 ℃; for 2h;
DOI:10.1021/jm00351a008

Reference yield:

: 82585-55-5
2-[2-[(E)-Hydroxyimino]-2-(4-trifluoromethyl-phenyl)-ethyl]-isoindole-1,3-dione

: 82585-71-5
{6-Amino-4-[2-[(Z)-hydroxyimino]-2-(4-trifluoromethyl-phenyl)-ethylamino]-5-nitro-pyridin-2-yl}-carbamic acid ethyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: hydrazine / ethanol / 22 h / 40 °C

2: 47 percent / Et₃N / ethanol / 2 h / 75 °C

With triethylamine; hydrazine; In ethanol;
DOI:10.1021/jm00351a008