1-Benzyl-1,4,5,6-tetrahydropyridine-3-carbonitrile

Base Information

Chemical Name:1-Benzyl-1,4,5,6-tetrahydropyridine-3-carbonitrile
CAS No.:75532-82-0
Molecular Formula:C13H14N2
Molecular Weight:198.268
Hs Code.:
DSSTox Substance ID:DTXSID40512258
Wikidata:Q82371426

Synonyms:75532-82-0;1-Benzyl-1,4,5,6-tetrahydropyridine-3-carbonitrile;SCHEMBL22092497;DTXSID40512258

Suppliers and Price of 1-Benzyl-1,4,5,6-tetrahydropyridine-3-carbonitrile

Supply Marketing:

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

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Chemical Property of 1-Benzyl-1,4,5,6-tetrahydropyridine-3-carbonitrile

Chemical Property:

XLogP3:2.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:198.115698455
Heavy Atom Count:15
Complexity:278

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC(=CN(C1)CC2=CC=CC=C2)C#N

Technology Process of 1-Benzyl-1,4,5,6-tetrahydropyridine-3-carbonitrile

There total 4 articles about 1-Benzyl-1,4,5,6-tetrahydropyridine-3-carbonitrile 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: 99.0%

: 37589-77-8
1-benzyl-1,4-dihydropyridine-3-carbonitrile

: 75532-82-0
1-benzyl-1,4,5,6-tetrahydropyridine-3-carboxamide

Guidance literature:: With palladium on activated charcoal; hydrogen; In ethanol; for 9h; under 760.051 Torr; regioselective reaction; Schlenk technique;
DOI:10.1021/jacs.5b12252

Reference yield:

: 14535-08-1
3-cyano-1-benzylpyridinium chloride

: 75532-82-0
1-benzyl-1,4,5,6-tetrahydropyridine-3-carboxamide

Guidance literature:: With hydrogen; triethylamine; palladium on activated charcoal; In methanol; for 0.333333h; under 2280 Torr;

Reference yield:

: 100-54-9,121697-66-3,1232169-17-3,68271-95-4
pyridine-3-carbonitrile

: 75532-82-0
1-benzyl-1,4,5,6-tetrahydropyridine-3-carboxamide

Guidance literature:: Multi-step reaction with 2 steps

1: 59 percent / 24 h / 60 - 70 °C

2: 0.84 g / triethylamine, H₂ / 10percent Pd/C / methanol / 0.33 h / 2280 Torr

With hydrogen; triethylamine; palladium on activated charcoal; In methanol;