Propanenitrile, 3,3'-(nitroimino)bis-

Base Information

• Chemical Name: Propanenitrile, 3,3'-(nitroimino)bis-
• CAS No.: 4164-33-4
• Molecular Formula: C6H8N4O2
• Molecular Weight: 168.155
• Hs Code.: 2928000090
• NSC Number: 202178,206140,206128
• UNII: A4J4DC7CAJ
• DSSTox Substance ID: DTXSID9063328
• Wikidata: Q81990665
• Mol file: 4164-33-4.mol

Synonyms:Propanenitrile, 3,3'-(nitroimino)bis-;4164-33-4;A4J4DC7CAJ;NSC 206140;3,3'-(Nitroimino)bis(propanenitrile);NSC 202178;NSC 206128;NSC-202178;NSC-206128;NSC-206140;C6H8N4O2;N,N-bis(2-cyanoethyl)nitramide;UNII-A4J4DC7CAJ;nitrobis(2 cyanoethyl)amine;DTXSID9063328;NSC202178;NSC206128;NSC206140;AKOS000505949;3,3'-(NITROIMINO)DIPROPIONITRILE

Chemical Property of Propanenitrile, 3,3'-(nitroimino)bis-

Chemical Property:

• Boiling Point: 475.2oC at 760 mmHg
• Flash Point: 241.2oC
• PSA: 96.64000
• Density: 1.251g/cm3
• LogP: 0.83066
• XLogP3: 0
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 168.06472551
• Heavy Atom Count: 12
• Complexity: 219

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CN(CCC#N)[N+](=O)[O-])C#N

Technology Process of Propanenitrile, 3,3'-(nitroimino)bis-

There total 1 articles about Propanenitrile, 3,3'-(nitroimino)bis- 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:

3,3'-Iminodipropionitrile (111-94-4) → bis(β-cyanoethyl)-N-nitramine (4164-33-4) + N-nitrosobis(2-cyanoethyl)amine (1116-82-1)

Guidance literature:

With silver(I) nitrite; I,I-bis(acetoxy)iodobenzene; In methanol; at 0 - 5 ℃; for 0.5h;

DOI:10.1007/s11172-009-0280-3

Reference yield:

bis(β-cyanoethyl)-N-nitramine (4164-33-4) → acrylonitrile (107-13-1,25014-41-9) + acrylic acid (79-10-7)

Guidance literature:

In various solvent(s); at 210 - 250 ℃; Further Variations:; Solvents; Temperatures; Kinetics;

DOI:10.1023/A:1020888031524

upstream raw materials:

3,3'-Iminodipropionitrile

Downstream raw materials:

acrylonitrile

acrylic acid

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