5-Chloro-2-(2,4-dichlorophenoxy)aniline

Base Information

• Chemical Name: 5-Chloro-2-(2,4-dichlorophenoxy)aniline
• CAS No.: 56966-52-0
• Molecular Formula: C12H8Cl3NO
• Molecular Weight: 288.561
• European Community (EC) Number: 260-480-4
• DSSTox Substance ID: DTXSID7069150
• Nikkaji Number: J267.156E
• Wikidata: Q81985341
• ChEMBL ID: CHEMBL2325385
• Mol file: 56966-52-0.mol

Synonyms:5-Chloro-2-(2,4-dichlorophenoxy)aniline;56966-52-0;EINECS 260-480-4;2,4,4'-Trichloro-2'-aminodiphenyl ether;EC 260-480-4;Benzenamine, 5-chloro-2-(2,4-dichlorophenoxy)-;SCHEMBL3652668;CHEMBL2325385;DTXSID7069150;AKOS009173009;SB82468;5-Chloro-2-(2,4-dichlorophenoxy)benzenamine;Aniline, 5-chloro-2-(2,4-dichlorophenoxy)-;EN300-74984;W-109241;Z330804486

Chemical Property of 5-Chloro-2-(2,4-dichlorophenoxy)aniline

Chemical Property:

• Vapor Pressure: 1.66E-05mmHg at 25°C
• Melting Point: 67 °C
• Refractive Index: 1.642
• Boiling Point: 364.6 °C at 760 mmHg
• PKA: 2.60±0.10(Predicted)
• Flash Point: 174.3 °C
• Density: 1.456 g/cm³
• Water Solubility.: 2.6mg/L at 20℃
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 286.967147
• Heavy Atom Count: 17
• Complexity: 254

Purity/Quality:

99.9% ^*data from raw suppliers

5-CHLORO-2-(2,4-DICHLOROPHENOXY)ANILINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1Cl)N)OC2=C(C=C(C=C2)Cl)Cl

Technology Process of 5-Chloro-2-(2,4-dichlorophenoxy)aniline

There total 6 articles about 5-Chloro-2-(2,4-dichlorophenoxy)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:

2,4,4'-trichloro-2'-nitrodiphenyl ether (2392-48-5) → 5-Chloro-2-(2',4'-dichlorophenoxy)aniline (56966-52-0)

Guidance literature:

With hydrogenchloride; tin(ll) chloride;

Reference yield:

2,4-dichloronitrobenzene (611-06-3) + 2,5-dichlorophenol (583-78-8) → 5-Chloro-2-(2',4'-dichlorophenoxy)aniline (56966-52-0)

Guidance literature:

With potassium hydroxide; sodium hydroxide; In 1,4-dioxane; aluminum nickel; water;

Reference yield:

2,5-dichloronitrobenzene (89-61-2) → 5-Chloro-2-(2',4'-dichlorophenoxy)aniline (56966-52-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 170 °C

2: SnCl₂; aqueous methanol.HCl

With hydrogenchloride; tin(ll) chloride;

upstream raw materials:

2,4,4'-trichloro-2'-nitrodiphenyl ether

5-chloro-2-(4-chloro-2-nitro-phenoxy)-benzenesulfonyl chloride

2,5-dichloronitrobenzene

2,4-dichlorophenol

Downstream raw materials:

2,2',4,4'-tetrachlorodiphenylether

2.4.4'-Trichlor-2'-(dimethylamino)-diphenylether

(4R)-N-(3-(5-chloro-2-(2,4-dichlorophenoxy)phenylamino)-3-oxopropyl)-2-(4-methoxyphenyl)-5,5-dimethyl-1,3-dioxane-4-carboxamide

C₁₃H₁₀Cl₃NO

Refernces

• 1、 Anderson, John W.,Sarantakis, Dimitri,Terpinski, Jacek,Santha Kumar,Tsai, Han-Chun,Kuo, MacK,Ager, Arba L.,Jacobs Jr., William R.,Schiehser, Guy A.,Ekins, Sean,Sacchettini, James C.,Jacobus, David P.,Fidock, David A.,Freundlich, Joel S.. "Novel diaryl ureas with efficacy in a mouse model of malaria". . p. 1022 - 1025. Retrieved 2013/03/13.
• 2、 -. "Process for the production of substituted N-methylbenzoxazines". . . Retrieved 2008/06/13.