1,3-Bis(4-cyanophenyl)prop-2-en-1-one

Base Information

Chemical Name:1,3-Bis(4-cyanophenyl)prop-2-en-1-one
CAS No.:58949-77-2
Molecular Formula:C17H10N2O
Molecular Weight:258.279
Hs Code.:
DSSTox Substance ID:DTXSID50404958

Synonyms:1,3-bis(4-cyanophenyl)prop-2-en-1-one;58949-77-2;DTXSID50404958;IRJNHDZXPVHAOH-UHFFFAOYSA-N;AKOS034380091;4-[3-(4-cyanophenyl)-1-oxo-2-propenyl]benzonitrile

Suppliers and Price of 1,3-Bis(4-cyanophenyl)prop-2-en-1-one

Supply Marketing:

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

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Chemical Property of 1,3-Bis(4-cyanophenyl)prop-2-en-1-one

Chemical Property:

XLogP3:2.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:258.079312947
Heavy Atom Count:20
Complexity:460

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1C=CC(=O)C2=CC=C(C=C2)C#N)C#N

Technology Process of 1,3-Bis(4-cyanophenyl)prop-2-en-1-one

There total 7 articles about 1,3-Bis(4-cyanophenyl)prop-2-en-1-one 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: 66.0%

: 1443-80-7
4-cyanophenyl methyl ketone

: 105-07-7
4-cyanobenzaldehyde

: 58949-77-2
1,3-bis(4-cyanophenyl)prop-2-en-1-one

Guidance literature:: 4-cyanophenyl methyl ketone; 4-cyanobenzaldehyde; In methanol; for 0.5h; Inert atmosphere; Reflux;

With sodium hydroxide; In methanol; water; for 0.25h; Inert atmosphere; Reflux;
DOI:10.1021/acs.jmedchem.1c00305

Reference yield:

: 874-89-5
4-Cyanobenzyl alcohol

: 58949-77-2
1,3-bis(4-cyanophenyl)prop-2-en-1-one

Guidance literature:: Multi-step reaction with 2 steps

1: dinitrogen tetraoxide; chloroform

2: ethanol; piperidine

With piperidine; ethanol; chloroform; dinitrogen tetraoxide;

Reference yield:

: 105-07-7
4-cyanobenzaldehyde

: 58949-77-2
4-<3'-(4-cyanophenyl)-3'-oxoprop-1'-enyl>benzonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: diethyl ether

2: Ac₂O, NaOAc

With sodium acetate; acetic anhydride; In diethyl ether;