(1-Methylpiperidin-4-ylidene)malononitrile

Base Information

• Chemical Name: (1-Methylpiperidin-4-ylidene)malononitrile
• CAS No.: 6945-39-7
• Molecular Formula: C₉H₁₁N₃
• Molecular Weight: 161.206
• Hs Code.: 2933399090
• NSC Number: 51129
• DSSTox Substance ID: DTXSID10989337
• Nikkaji Number: J636.127G
• Wikidata: Q82978355
• Mol file: 6945-39-7.mol

Synonyms:(1-methylpiperidin-4-ylidene)malononitrile;6945-39-7;Propanedinitrile,2-(1-methyl-4-piperidinylidene)-;(1-methylpiperidin-4-ylidene)propanedinitrile;2-(1-methylpiperidin-4-ylidene)propanedinitrile;NSC51129;DTXSID10989337;NSC-51129;STK820891;AKOS005177661

Chemical Property of (1-Methylpiperidin-4-ylidene)malononitrile

Chemical Property:

• Vapor Pressure: 0.000672mmHg at 25°C
• Boiling Point: 308.6°C at 760 mmHg
• Flash Point: 136°C
• PSA: 50.82000
• Density: 1.102g/cm³
• LogP: 0.99366
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 161.095297364
• Heavy Atom Count: 12
• Complexity: 268

Purity/Quality:

99% ^*data from raw suppliers

2-(1-methyl-4-piperidinylidene)-Propanedinitrile 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCC(=C(C#N)C#N)CC1

Technology Process of (1-Methylpiperidin-4-ylidene)malononitrile

There total 1 articles about (1-Methylpiperidin-4-ylidene)malononitrile 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: 71.3%

1-Methyl-4-piperidone (1445-73-4) + malononitrile (109-77-3) → 1-methyl-4-piperidylidenemalononitrile (6945-39-7)

Guidance literature:

In diethyl ether; at 0 ℃; for 1.5h;

upstream raw materials:

1-Methyl-4-piperidone

malononitrile

Refernces

• 1、 Kryukov, L. N.,Sinyakov, Yu. V.. "1-METHYL-4-PIPERIDONE IN REACTIONS WITH CH-ACIDS". . p. 1142 - 1144. Retrieved 2007/10/02.