4-(2-Oxo-1(2H)-pyridinyl)benzonitrile

Base Information

Chemical Name:4-(2-Oxo-1(2H)-pyridinyl)benzonitrile
CAS No.:444002-96-4
Molecular Formula:C12H8N2O
Molecular Weight:196.208
Hs Code.:
DSSTox Substance ID:DTXSID80479836
Nikkaji Number:J2.373.326I
Wikidata:Q72499141
Mol file:444002-96-4.mol

Synonyms:444002-96-4;4-(2-OXO-1(2H)-PYRIDINYL)BENZONITRILE;1-(4-cyanophenyl)-1H-pyridin-2-one;SCHEMBL85902;DTXSID80479836;AKOS025402364;AC-8462;4-(2-Oxopyridin-1(2H)-yl)benzonitrile;FT-0705229

Suppliers and Price of 4-(2-Oxo-1(2H)-pyridinyl)benzonitrile

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 10 raw suppliers

Chemical Property of 4-(2-Oxo-1(2H)-pyridinyl)benzonitrile

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Melting Point:165-166 °C
Refractive Index:1.653
Boiling Point:424.443 °C at 760 mmHg
Flash Point:210.496 °C
PSA：45.79000
Density:1.277 g/cm³
LogP:1.70918
XLogP3:1.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:196.063662883
Heavy Atom Count:15
Complexity:353

Purity/Quality:: 98%Min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=O)N(C=C1)C2=CC=C(C=C2)C#N

Technology Process of 4-(2-Oxo-1(2H)-pyridinyl)benzonitrile

There total 5 articles about 4-(2-Oxo-1(2H)-pyridinyl)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: 70.0%

: 142-08-5
2-hydroxypyridin

: 623-00-7
4-bromobenzenecarbonitrile

: 444002-96-4
4-[2-oxopyridin-1(2H)-yl]benzonitrile

Guidance literature:: With copper(l) iodide; potassium carbonate; trans-N,N'-dimethylcyclohexane-1,2-diamine; In toluene; for 12h; Heating;
DOI:10.1016/j.tet.2005.01.063

Reference yield: 66.0%

: 142-08-5
2-hydroxypyridin

: 3058-39-7
4-iodobenzonitrile

: 444002-96-4
4-[2-oxopyridin-1(2H)-yl]benzonitrile

Guidance literature:: With copper(l) iodide; 8-quinolinol; caesium carbonate; In dimethyl sulfoxide; at 120 ℃;

Reference yield:

: 142-08-5,1199357-22-6
2-Pyridone

: 3058-39-7
4-iodobenzonitrile

: 444002-96-4
4-[2-oxopyridin-1(2H)-yl]benzonitrile

Guidance literature:: With copper(l) iodide; potassium carbonate; In N,N-dimethyl-formamide; at 150 ℃; for 6h; Inert atmosphere; Schlenk technique;
DOI:10.1021/acs.orglett.7b01159