4,5-Dichloro-N-ethyl-2-nitroaniline

Base Information

• Chemical Name: 4,5-Dichloro-N-ethyl-2-nitroaniline
• CAS No.: 63059-56-3
• Molecular Formula: C8H8 Cl2 N2 O2
• Molecular Weight: 235.07
• European Community (EC) Number: 263-826-2
• UNII: XR04URS7LX
• DSSTox Substance ID: DTXSID2069658
• Nikkaji Number: J28.362B
• Wikidata: Q81996617
• Mol file: 63059-56-3.mol

Synonyms:4,5-Dichloro-N-ethyl-2-nitroaniline;63059-56-3;Benzenamine, 4,5-dichloro-N-ethyl-2-nitro-;N-Ethyl-4,5-dichloro-2-nitroaniline;XR04URS7LX;EINECS 263-826-2;UNII-XR04URS7LX;DTXSID2069658;SCHEMBL16406347;MFCD00024302;STK396437;AKOS000507300;SB81184;CS-0331545;F0293-0133

Chemical Property of 4,5-Dichloro-N-ethyl-2-nitroaniline

Chemical Property:

• Vapor Pressure: 1.45E-05mmHg at 25°C
• Boiling Point: 366.6°C at 760 mmHg
• Flash Point: 175.5°C
• Density: 1.458g/cm³
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 233.9962829
• Heavy Atom Count: 14
• Complexity: 210

Purity/Quality:

98%Min ^*data from raw suppliers

4,5-DICHLORO-N-ETHYL-2-NITROANILINE Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCNC1=CC(=C(C=C1[N+](=O)[O-])Cl)Cl

Technology Process of 4,5-Dichloro-N-ethyl-2-nitroaniline

There total 5 articles about 4,5-Dichloro-N-ethyl-2-nitroaniline 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: 52.0%

2,4,5-Trichloronitrobenzene (89-69-0) + ethylamine (75-04-7,85404-22-4) → N-ethyl-4,5-dichloro-2-nitro-aniline (63059-56-3)

Guidance literature:

In methanol; for 10h; Heating;

Reference yield:

1,2-dichloro-4-fluoro-5-nitrobenzene (2339-78-8) + ethylamine (75-04-7,85404-22-4) → N-ethyl-4,5-dichloro-2-nitro-aniline (63059-56-3)

Guidance literature:

With potassium carbonate; In tetrahydrofuran; at 90 ℃; for 1h; Microwave irradiation;

Reference yield:

1,2-dichloro-benzene (95-50-1) → N-ethyl-4,5-dichloro-2-nitro-aniline (63059-56-3)

Guidance literature:

Multi-step reaction with 2 steps

1: beim Nitrieren

2: alcohol

With ethanol;

upstream raw materials:

2,4,5-Trichloronitrobenzene

ethylamine

1,2-dichloro-4,5-dinitrobenzene

1,2-dichloro-benzene

Downstream raw materials:

4.5-Dichlor-N-aethyl-phenylendiamin-(1.2)