4,4'-Oxydibutanenitrile

Base Information

• Chemical Name: 4,4'-Oxydibutanenitrile
• CAS No.: 176720-03-9
• Molecular Formula: C8H12N2O
• DSSTox Substance ID: DTXSID80571228
• Nikkaji Number: J900.150F
• Wikidata: Q82459261
• Mol file: 176720-03-9.mol

Synonyms:4,4'-Oxydibutanenitrile;176720-03-9;Butanenitrile, 4,4'-oxybis-;3-cyanopropyl ether;4-(3-CYANOPROPOXY)BUTANENITRILE;SCHEMBL11771559;DTXSID80571228

Chemical Property of 4,4'-Oxydibutanenitrile

Chemical Property:

• XLogP3: 0.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 152.094963011
• Heavy Atom Count: 11
• Complexity: 151

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CC#N)COCCCC#N

Technology Process of 4,4'-Oxydibutanenitrile

There total 1 articles about 4,4'-Oxydibutanenitrile 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:

Pentaerythritol (115-77-5) + acrylonitrile (107-13-1,25014-41-9) → tetrakis-[(2-cyanoethoxy)methyl]methane (2465-91-0) + 4-oxa-1,7-dicyanoheptane (176720-03-9)

Guidance literature:

With N-benzyl-trimethylammonium hydroxide; In water; for 8h; Yields of byproduct given;

DOI:10.1080/00304949609356531

upstream raw materials:

Pentaerythritol

acrylonitrile