2-(2-Oxo-2-(pyridin-4-YL)ethyl)malononitrile

Base Information

Chemical Name:2-(2-Oxo-2-(pyridin-4-YL)ethyl)malononitrile
CAS No.:610270-72-9
Molecular Formula:C₁₀H₇N₃O
Molecular Weight:185.185
Hs Code.:
DSSTox Substance ID:DTXSID30452977
Wikidata:Q82273913
Mol file:610270-72-9.mol

Synonyms:2-(2-OXO-2-(PYRIDIN-4-YL)ETHYL)MALONONITRILE;610270-72-9;DTXSID30452977;AKOS006294841;AB25464;2-[2-OXO-2-(PYRIDIN-4-YL)ETHYL]PROPANEDINITRILE

Suppliers and Price of 2-(2-Oxo-2-(pyridin-4-YL)ethyl)malononitrile

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Total 1 raw suppliers

Chemical Property of 2-(2-Oxo-2-(pyridin-4-YL)ethyl)malononitrile

Chemical Property:

PSA：77.54000
LogP:1.31776
XLogP3:0.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:185.058911855
Heavy Atom Count:14
Complexity:284

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CN=CC=C1C(=O)CC(C#N)C#N

Technology Process of 2-(2-Oxo-2-(pyridin-4-YL)ethyl)malononitrile

There total 2 articles about 2-(2-Oxo-2-(pyridin-4-YL)ethyl)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: 53.0%

: 5349-17-7
4-bromoacetylpyridine hydrobromide

: 109-77-3
malononitrile

: 610270-72-9
2-(2-oxo-2-pyridin-4-yl-ethyl)-malononitrile

Guidance literature:: With sodium hydroxide; In ethanol;
DOI:10.1021/jm0301787

Reference yield:

: 1122-54-9
methyl (4-pyridyl) ketone

: 610270-72-9
2-(2-oxo-2-pyridin-4-yl-ethyl)-malononitrile

Guidance literature:: Multi-step reaction with 2 steps

1: Br₂; HBr / acetic acid / 0 - 5 °C

2: 53 percent / aq. NaOH / ethanol

With sodium hydroxide; hydrogen bromide; bromine; In ethanol; acetic acid;
DOI:10.1021/jm0301787