4-[2-(4-Methylphenyl)-2-oxoethyl]benzonitrile

Base Information

Chemical Name:4-[2-(4-Methylphenyl)-2-oxoethyl]benzonitrile
CAS No.:59483-79-3
Molecular Formula:C16H13NO
Molecular Weight:235.285
Hs Code.:
NSC Number:103100
DSSTox Substance ID:DTXSID90974887
Nikkaji Number:J1.604.797J
Wikidata:Q82959349

Synonyms:59483-79-3;4-[2-(4-methylphenyl)-2-oxoethyl]benzonitrile;NSC103100;DTXSID90974887;NSC-103100

Suppliers and Price of 4-[2-(4-Methylphenyl)-2-oxoethyl]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 5 raw suppliers

Chemical Property of 4-[2-(4-Methylphenyl)-2-oxoethyl]benzonitrile

Chemical Property:

Vapor Pressure:4.33E-07mmHg at 25°C
Boiling Point:414.8°Cat760mmHg
Flash Point:204.7°C
Density:1.14g/cm³
XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:235.099714038
Heavy Atom Count:18
Complexity:324

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(C=C1)C(=O)CC2=CC=C(C=C2)C#N

Technology Process of 4-[2-(4-Methylphenyl)-2-oxoethyl]benzonitrile

There total 8 articles about 4-[2-(4-Methylphenyl)-2-oxoethyl]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: 84.0%

: 59483-79-3
2-(4-cyanophenyl)-1-(4-methylphenyl)ethanone

Guidance literature:: With water monomer; trifluoromethane sulfonic acid silver salt; In chlorobenzene; at 100 ℃; for 44h; Sealed tube; Inert atmosphere;

Reference yield: 64.2%

: 101-82-6
2-Benzylpyridine

: 104-85-8
para-methylbenzonitrile

: 59483-79-3
2-(4-cyanophenyl)-1-(4-methylphenyl)ethanone

Guidance literature:: 2-Benzylpyridine; With n-butyllithium; In tetrahydrofuran; hexane; at 0 - 20 ℃; for 24h; Inert atmosphere; Schlenk technique;

para-methylbenzonitrile; In tetrahydrofuran; hexane; at 0 - 20 ℃; for 48h; Inert atmosphere; Schlenk technique;

With sulfuric acid; water; In tetrahydrofuran; hexane; pH=1; Inert atmosphere; Schlenk technique; Cooling with ice;
DOI:10.1016/j.jorganchem.2017.10.042