4-(Pyridin-3-ylmethyl)benzonitrile

Base Information

Chemical Name:4-(Pyridin-3-ylmethyl)benzonitrile
CAS No.:112809-49-1
Molecular Formula:C13H10N2
Molecular Weight:194.23200
Hs Code.:
DSSTox Substance ID:DTXSID10557752
Wikidata:Q82439752
Mol file:112809-49-1.mol

Synonyms:4-(Pyridin-3-ylmethyl)benzonitrile;112809-49-1;SCHEMBL1507736;DTXSID10557752;4-(3-pyridylmethyl)-benzonitrile;BSYVIJZXPRACHS-UHFFFAOYSA-N;(S)-2,2-Dimethoxy-1,1-binaphthyl;4-[(Pyridin-3-yl)methyl]benzonitrile

Suppliers and Price of 4-(Pyridin-3-ylmethyl)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

Crysdot
4-(Pyridin-3-ylmethyl)benzonitrile 95+%
1g
$ 772.00

Chemenu
4-(pyridin-3-ylmethyl)benzonitrile 95%
1g
$ 729.00

American Custom Chemicals Corporation
4-(PYRIDIN-3-YLMETHYL)BENZONITRILE 95.00%
5G
$ 2887.50

Alichem
4-(Pyridin-3-ylmethyl)benzonitrile
1g
$ 634.28

Total 8 raw suppliers

Chemical Property of 4-(Pyridin-3-ylmethyl)benzonitrile

Chemical Property:

Vapor Pressure:1.78E-05mmHg at 25°C
Boiling Point:363.6oC at 760 mmHg
Flash Point:125.1oC
PSA：36.68000
Density:1.14g/cm3
LogP:2.54408
Storage Temp.:2-8°C
XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:194.084398327
Heavy Atom Count:15
Complexity:232

Purity/Quality:

98%min ^*data from raw suppliers

4-(Pyridin-3-ylmethyl)benzonitrile 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 4-(Pyridin-3-ylmethyl)benzonitrile

There total 7 articles about 4-(Pyridin-3-ylmethyl)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: 89.0%

: N,N,N-trimethyl-1-(4-cyanophenyl)methanaminium trifluoromethanesulfonate

: 1692-25-7
3-pyridylboronic acid

: 112809-49-1
4-(pyridin-3-ylmethyl)benzonitrile

Guidance literature:: With sodium carbonate; triphenylphosphine; palladium dichloride; In ethanol; at 100 ℃;
DOI:10.1039/C7RA02549A

Reference yield: 75.0%

: (3-pyridyl)AlEt₂(OEt₂)

: 874-86-2
4-cyanobenzyl chloride

: 112809-49-1
4-(pyridin-3-ylmethyl)benzonitrile

Guidance literature:: With palladium diacetate; tris-(o-tolyl)phosphine; In toluene; at 60 ℃; for 10h; Inert atmosphere;
DOI:10.1021/jo4024123