Naphthalene-1,7-dicarbonitrile

Base Information

• Chemical Name: Naphthalene-1,7-dicarbonitrile
• CAS No.: 95596-45-5
• Molecular Formula: C₁₂H₆N₂
• Molecular Weight: 178.193
• DSSTox Substance ID: DTXSID00606223
• Nikkaji Number: J2.839.878F
• Wikidata: Q82504880
• Mol file: 95596-45-5.mol

Synonyms:95596-45-5;Naphthalene-1,7-dicarbonitrile;SCHEMBL819093;DTXSID00606223;DB-083900

Chemical Property of Naphthalene-1,7-dicarbonitrile

Chemical Property:

• PSA: 47.58000
• LogP: 2.58316
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 178.053098200
• Heavy Atom Count: 14
• Complexity: 303

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC2=C(C=C(C=C2)C#N)C(=C1)C#N

Technology Process of Naphthalene-1,7-dicarbonitrile

There total 6 articles about Naphthalene-1,7-dicarbonitrile 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:

→ 1,7-Dicyan-naphthalin (95596-45-5)

Guidance literature:

With carbon dioxide; at 340 - 450 ℃;

DOI:10.1039/jr9360001739

Reference yield:

potassium cyanide (151-50-8) → 1,7-Dicyan-naphthalin (95596-45-5)

Guidance literature:

DOI:10.1039/jr9390000253

Reference yield:

7-cyano-naphthalene-1-sulfonic acid + potassium cyanide (151-50-8) → 1,7-Dicyan-naphthalin (95596-45-5)

Guidance literature:

upstream raw materials:

potassium cyanide

hydrogen cyanide