3-ethoxy-N-phenylaniline

Base Information

• Chemical Name: 3-ethoxy-N-phenylaniline
• CAS No.: 43035-14-9
• Molecular Formula: C14H15NO
• Molecular Weight: 213.279
• Hs Code.: 2922299090
• DSSTox Substance ID: DTXSID90544605
• Nikkaji Number: J490.464H
• Wikidata: Q82421767
• Mol file: 43035-14-9.mol

Synonyms:3-ethoxy-N-phenylaniline;43035-14-9;3-ETHOXYDIPHENYLAMINE;3-ethoxy-N-phenyl-aniline;SCHEMBL7986906;DTXSID90544605;AKOS015901389;A826112

Chemical Property of 3-ethoxy-N-phenylaniline

Chemical Property:

• Boiling Point: 343.9 °C at 760 mmHg
• Flash Point: 139.9 °C
• PSA: 21.26000
• Density: 1.088 g/cm³
• LogP: 3.90190
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 213.115364102
• Heavy Atom Count: 16
• Complexity: 189

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC1=CC=CC(=C1)NC2=CC=CC=C2

Technology Process of 3-ethoxy-N-phenylaniline

There total 6 articles about 3-ethoxy-N-phenylaniline 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: 80.0%

3-hydroxy-N-phenylaniline (101-18-8) + ethyl iodide (75-03-6) → 3-ethoxydiphenylamine (43035-14-9)

Guidance literature:

With potassium hydroxide; In ethanol;

DOI:10.1246/bcsj.59.803

Reference yield: 73.0%

(3-ethoxyphenyl)boronic acid (90555-66-1) + aniline (62-53-3) → 3-ethoxydiphenylamine (43035-14-9)

Guidance literature:

With pyridine; copper diacetate; triethylamine; In dichloromethane; at 25 ℃; for 2h; Continuous flow microreactor;

DOI:10.1016/j.tetlet.2008.09.159

Reference yield:

ethyl bromide (74-96-4) + 3-hydroxy-N-phenylaniline (101-18-8) → 3-ethoxydiphenylamine (43035-14-9)

Guidance literature:

With tetrabutylammomium bromide; sodium hydroxide; In 5,5-dimethyl-1,3-cyclohexadiene; water; at 83 ℃; for 7h; Inert atmosphere;

upstream raw materials:

diethyl sulfate

3-hydroxy-N-phenylaniline

ethyl iodide

(3-ethoxyphenyl)boronic acid

Downstream raw materials:

2-ethoxy-N⁴-phenyl-p-phenylenediamine

N-(3-ethoxy-4-nitro-phenyl)-N-phenyl-acetamide

4-ethoxy-N²-phenyl-o-phenylenediamine

N-phenyl-N-(3-ethoxy-phenyl)-acetamide

Refernces

• 1、 Singh, Brajendra K.,Stevens, Christian V.,Acke, Davy R.J.,Parmar, Virinder S.,Van der Eycken, Erik V.. "Copper-mediated N- and O-arylations with arylboronic acids in a continuous flow microreactor: a new avenue for efficient scalability". scheme or table. p. 15 - 18. Retrieved 2009/04/10.