4-(6-Oxo-1,4,5,6-tetrahydropyridazin-3-yl)benzonitrile

Base Information

Chemical Name:4-(6-Oxo-1,4,5,6-tetrahydropyridazin-3-yl)benzonitrile
CAS No.:36725-21-0
Molecular Formula:C11H9N3O
Molecular Weight:199.212
Hs Code.:
DSSTox Substance ID:DTXSID60540412
Wikidata:Q82416417

Synonyms:36725-21-0;SCHEMBL11006840;DTXSID60540412;4-(6-Oxo-1,4,5,6-tetrahydropyridazin-3-yl)benzonitrile

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

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Chemical Property of 4-(6-Oxo-1,4,5,6-tetrahydropyridazin-3-yl)benzonitrile

Chemical Property:

XLogP3:0.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:199.074561919
Heavy Atom Count:15
Complexity:331

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1CC(=O)NN=C1C2=CC=C(C=C2)C#N

Technology Process of 4-(6-Oxo-1,4,5,6-tetrahydropyridazin-3-yl)benzonitrile

There total 1 articles about 4-(6-Oxo-1,4,5,6-tetrahydropyridazin-3-yl)benzonitrile 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:

: 36725-21-0
4-(6-oxo-1,4,5,6-tetrahydropyridazin-3-yl)benzonitrile

Guidance literature:: aus 6-(p-Aminophenyl)-4,5-dihydro-3(2H)-pyridazinon durch Sandmeyer-Reaktion;
DOI:10.1021/jm00249a004

Reference yield: 97.0%

: 36725-21-0
4-(6-oxo-1,4,5,6-tetrahydropyridazin-3-yl)benzonitrile

: 52240-10-5
4-(1,6-dihydro-6-oxo-3-pyridazinyl)benzonitrile

Guidance literature:: With pyridine; oxygen; copper diacetate; sodium carbonate; In toluene; at 20 - 100 ℃; for 12h; chemoselective reaction;
DOI:10.1002/ejoc.201300640

Reference yield: 76.0%

: 501-65-5
diphenyl acetylene

: 36725-21-0
4-(6-oxo-1,4,5,6-tetrahydropyridazin-3-yl)benzonitrile

: (E)-4-(1-(1,2-diphenylvinyl)-6-oxo-1,4,5,6-tetrahydropyridazin-3-yl)benzonitrile

Guidance literature:: With ruthenium trichloride; chloromethyltriphenylphosphonium chloride; In N,N-dimethyl-formamide; at 120 ℃; for 12h; Inert atmosphere;
DOI:10.1002/ejoc.201402986