3-[2-(2-Hydroxyethoxy)ethoxy]propanenitrile

Base Information

• Chemical Name: 3-[2-(2-Hydroxyethoxy)ethoxy]propanenitrile
• CAS No.: 10143-54-1
• Molecular Formula: C7H13 N O3
• Molecular Weight: 159.185
• Hs Code.: 2926909090
• European Community (EC) Number: 600-212-9
• DSSTox Substance ID: DTXSID70906186
• Nikkaji Number: J51.101C
• Wikidata: Q82874858
• Mol file: 10143-54-1.mol

Synonyms:3-[2-(2-Hydroxyethoxy)ethoxy]propanenitrile;10143-54-1;BRN 1764568;Diethylene glycol mono-2-cyanoethyl ether;Propionitrile, 3-(2-(2-hydroxyethoxy)ethoxy)-;4-03-00-00713 (Beilstein Handbook Reference);Propanenitrile, 3-(2-(2-hydroxyethoxy)ethoxy)-;Propanenitrile, 3-[2-(2-hydroxyethoxy)ethoxy]-;Propionitrile, 3-[2-(2-hydroxyethoxy)ethoxy]-;SCHEMBL4852726;DTXSID70906186;AKOS037646056;AS-66070;LS-124935;D86324;EN300-248285

Chemical Property of 3-[2-(2-Hydroxyethoxy)ethoxy]propanenitrile

Chemical Property:

• Vapor Pressure: 4.09E-05mmHg at 25°C
• Refractive Index: 1.4452 (estimate)
• Boiling Point: 314.2°Cat760mmHg
• Flash Point: 143.8°C
• PSA: 62.48000
• Density: 1.077g/cm³
• LogP: -0.07442
• XLogP3: -1.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 159.08954328
• Heavy Atom Count: 11
• Complexity: 118

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-[2-(2-Hydroxyethoxy)ethoxy]propanenitrile ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(COCCOCCO)C#N

Technology Process of 3-[2-(2-Hydroxyethoxy)ethoxy]propanenitrile

There total 5 articles about 3-[2-(2-Hydroxyethoxy)ethoxy]propanenitrile 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: 49.0%

3-Chloropropionitrile (542-76-7) + diethylene glycol (111-46-6) → 3-(2-(2-hydroxyethoxy)ethoxy)propanenitrile (10143-54-1) + bis(2-(2-cyanoethoxy)ethyl)ether (22397-31-5)

Guidance literature:

With sodium hydroxide; Yield given. Multistep reaction; 1) benzene, 70 to 80 deg C_.;

Reference yield: 47.0%

acrylonitrile (107-13-1,25014-41-9) + diethylene glycol (111-46-6) → 3-(2-(2-hydroxyethoxy)ethoxy)propanenitrile (10143-54-1)

Guidance literature:

With sodium hydroxide; at 45 ℃;

Reference yield:

bis(2-(2-cyanoethoxy)ethyl)ether (22397-31-5) + diethylene glycol (111-46-6) → 3-(2-(2-hydroxyethoxy)ethoxy)propanenitrile (10143-54-1)

Guidance literature:

With sodium hydroxide;

upstream raw materials:

acrylonitrile

diethylene glycol

bis(2-(2-cyanoethoxy)ethyl)ether

3-Chloropropionitrile

Downstream raw materials:

4,7,10-trioxa-1,13-diaminotridecane

2-[2-(3-amino-propoxy)-ethoxy]-ethanol

diethylene glycol