3-Oxo-3-(pyridin-4-YL)propanenitrile

Base Information

Chemical Name:3-Oxo-3-(pyridin-4-YL)propanenitrile
CAS No.:23821-37-6
Molecular Formula:C8H6N2O
Molecular Weight:146.15
Hs Code.:2933399990
European Community (EC) Number:813-610-4
DSSTox Substance ID:DTXSID50577590
Wikidata:Q72499153
Mol file:23821-37-6.mol

Synonyms:23821-37-6;3-OXO-3-(PYRIDIN-4-YL)PROPANENITRILE;3-OXO-3-PYRIDIN-4-YL-PROPIONITRILE;3-Oxo-3-pyridin-4-ylpropanenitrile;3-Oxo-3-(4-pyridinyl)propanenitrile;3-oxo-3-(4-pyridyl)propanenitrile;MFCD06656807;3-OXO-3-PYRIDIN-4-ylprOPIONITRILE;Beta-oxo-4-pyridinepropanenitrile;isonicotinoyl-acetonitril;SCHEMBL237747;DTXSID50577590;PPBAZOANEQPCKG-UHFFFAOYSA-N;AMY21430;FD6076;AKOS009305166;4-Pyridinepropanenitrile, .beta.-oxo-;PS-4680;SB35940;SY101520;A4969;CS-0044003;3-oxo-3-pyridin-4-ylpropanenitrile, AldrichCPR;W-206856;3-oxo-3-(pyridin-4-yl)propanenitrile;3-Oxo-3-pyridin-4-yl-propionitrile

Suppliers and Price of 3-Oxo-3-(pyridin-4-YL)propanenitrile

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

TRC
3-Oxo-3-(pyridin-4-yl)propanenitrile
100mg
$ 60.00

SynQuest Laboratories
3-Oxo-3-pyridin-4-ylpropanenitrile
1 g
$ 212.00

Matrix Scientific
3-Oxo-3-pyridin-4-ylpropanenitrile 98%
1g
$ 235.00

J&W Pharmlab
3-Oxo-3-pyridin-4-yl-propionitrile 97%
500mg
$ 88.00

J&W Pharmlab
3-Oxo-3-pyridin-4-yl-propionitrile 97%
250mg
$ 78.00

J&W Pharmlab
3-Oxo-3-pyridin-4-yl-propionitrile 97%
1g
$ 98.00

J&W Pharmlab
3-Oxo-3-pyridin-4-yl-propionitrile 97%
5g
$ 398.00

J&W Pharmlab
3-Oxo-3-pyridin-4-yl-propionitrile 97%
25g
$ 1590.00

Crysdot
3-Oxo-3-(pyridin-4-yl)propanenitrile 95+%
10g
$ 604.00

Crysdot
3-Oxo-3-(pyridin-4-yl)propanenitrile 95+%
5g
$ 347.00

Total 42 raw suppliers

Chemical Property of 3-Oxo-3-(pyridin-4-YL)propanenitrile

Chemical Property:

Vapor Pressure:0.000121mmHg at 25°C
Refractive Index:1.539
Boiling Point:335.3 °C at 760 mmHg
PKA:6.29±0.10(Predicted)
Flash Point:156.6 °C
PSA：53.75000
Density:1.177 g/cm³
LogP:1.17798
Storage Temp.:under inert gas (nitrogen or Argon) at 2-8°C
XLogP3:0.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:146.048012819
Heavy Atom Count:11
Complexity:186

Purity/Quality:

99%, ^*data from raw suppliers

3-Oxo-3-(pyridin-4-yl)propanenitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s): T
Hazard Codes:T,Xn
Statements: 22-37/38-41
Safety Statements: 26-39

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 3-Oxo-3-(pyridin-4-YL)propanenitrile

There total 4 articles about 3-Oxo-3-(pyridin-4-YL)propanenitrile 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: 76.0%

: 2459-09-8
4-pyridinecarboxylic acid, methyl ester

: 75-05-8,26809-02-9
acetonitrile

: 23821-37-6
3-oxo-3-(pyridin-4-yl)propanenitrile

Guidance literature:: acetonitrile; With sodium hydride; In dimethyl sulfoxide; at 20 ℃; for 0.25h;

4-pyridinecarboxylic acid, methyl ester; In dimethyl sulfoxide; at 20 - 60 ℃; for 16.17h;