4-(2-Ethoxyethoxy)aniline

Base Information

• Chemical Name: 4-(2-Ethoxyethoxy)aniline
• CAS No.: 65999-71-5
• Molecular Formula: C10H15NO2
• Molecular Weight: 181.235
• Hs Code.: 2922299090
• DSSTox Substance ID: DTXSID30586403
• Wikidata: Q82478524

Synonyms:4-(2-ethoxyethoxy)aniline;65999-71-5;SCHEMBL3017509;DTXSID30586403;BBL023586;STL066982;AKOS000215507;MCULE-6302612789;DB-105854;EN300-1295850

Chemical Property of 4-(2-Ethoxyethoxy)aniline

Chemical Property:

• Vapor Pressure: 0.001mmHg at 25°C
• Boiling Point: 308.725oC at 760 mmHg
• PKA: 5.11±0.10(Predicted)
• Flash Point: 153.339oC
• PSA: 44.48000
• Density: 1.056g/cm3
• LogP: 2.26530
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 181.110278721
• Heavy Atom Count: 13
• Complexity: 122

Purity/Quality:

98%Min ^*data from raw suppliers

4-(2-ethoxyethoxy)anilineHydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOCCOC1=CC=C(C=C1)N

Technology Process of 4-(2-Ethoxyethoxy)aniline

There total 3 articles about 4-(2-Ethoxyethoxy)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: 39.0%

→ 4-(2-ethoxy-ethoxy)-aniline (65999-71-5)

Guidance literature:

With water; In ethanol; for 3h; Reflux;

Reference yield:

2-ethoxy-ethanol (110-80-5) + 4-chlorobenzonitrile (100-00-5) → 4-(2-ethoxy-ethoxy)-aniline (65999-71-5) + 1-n-ethoxy-2-(4-nitrophenoxy)-ethane (19594-21-9)

Guidance literature:

In water; dimethyl sulfoxide;

Reference yield:

1-n-ethoxy-2-(4-nitrophenoxy)-ethane (19594-21-9) → 4-(2-ethoxy-ethoxy)-aniline (65999-71-5)

Guidance literature:

With iron; acetic acid;

upstream raw materials:

1-n-ethoxy-2-(4-nitrophenoxy)-ethane

2-ethoxy-ethanol

4-chlorobenzonitrile

Downstream raw materials:

[4-(2-ethoxy-ethoxy)-phenyl]-carbamic acid-(2-diethylamino-ethyl ester)

4-(2-ethoxy-ethoxy)-phenyl isocyanate

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