4-[3-(4-Methylphenyl)-3-oxoprop-1-enyl]benzonitrile

Base Information

Chemical Name:4-[3-(4-Methylphenyl)-3-oxoprop-1-enyl]benzonitrile
CAS No.:62584-58-1
Molecular Formula:C17H13NO
Molecular Weight:247.296
Hs Code.:
DSSTox Substance ID:DTXSID90398524

Synonyms:4-[3-(4-methylphenyl)-3-oxoprop-1-enyl]benzonitrile;62584-58-1;DTXSID90398524

Suppliers and Price of 4-[3-(4-Methylphenyl)-3-oxoprop-1-enyl]benzonitrile

Supply Marketing:

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

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Chemical Property of 4-[3-(4-Methylphenyl)-3-oxoprop-1-enyl]benzonitrile

Chemical Property:

XLogP3:3.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:247.099714038
Heavy Atom Count:19
Complexity:373

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 4-[3-(4-Methylphenyl)-3-oxoprop-1-enyl]benzonitrile

There total 1 articles about 4-[3-(4-Methylphenyl)-3-oxoprop-1-enyl]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: 49.0%

: 122-00-9
para-methylacetophenone

: 105-07-7
4-cyanobenzaldehyde

: 62584-58-1
3-(4-cyanophenyl)-1-(4-methylphenyl)-2-propen-1-one

Guidance literature:: With potassium hydroxide; In methanol; water; at 20 ℃; for 0.5h;
DOI:10.1002/ejoc.201901663

Reference yield: 80.0%

: 75-52-5
nitromethane

: 62584-58-1
3-(4-cyanophenyl)-1-(4-methylphenyl)-2-propen-1-one

: 3-(4-(cyanophenyl))-4-nitro-1-(p-tolyl)butan-1-one

Guidance literature:: With diethylamine; Inert atmosphere; Reflux;
DOI:10.1021/acs.joc.9b01311

Reference yield: 76.0%

: 62584-58-1
3-(4-cyanophenyl)-1-(4-methylphenyl)-2-propen-1-one

: 1-amino-1-(4-methylphenyl)-2-(2-pyridyl)ethene

: 4-(4-cyanophenyl)-2,6-bis(4-methylphenyl)-3-(2-pyridyl)pyridine

Guidance literature:: With iron(III) chloride; In acetonitrile; at 180 ℃; for 1h; Microwave irradiation; Sealed tube;
DOI:10.1002/ejoc.201901663