4(3H)-Pyrimidinone, 3-(1-(4-chlorobenzoyl)ethenyl)-

Base Information

Chemical Name:4(3H)-Pyrimidinone, 3-(1-(4-chlorobenzoyl)ethenyl)-
CAS No.:108664-29-5
Molecular Formula:C₁₃H₉ClN₂O₂
Molecular Weight:260.68
Hs Code.:
DSSTox Substance ID:DTXSID40910811
Wikidata:Q82880825
ChEMBL ID:CHEMBL3559616
Mol file:108664-29-5.mol

Synonyms:108664-29-5;4(3H)-Pyrimidinone, 3-(1-(4-chlorobenzoyl)ethenyl)-;4(3H)-Pyrimidinone, 3-[1-(4-chlorobenzoyl)ethenyl]-;CHEMBL3559616;DTXSID40910811;3-[1-(4-chlorobenzoyl)vinyl]pyrimidin-4-one;3-[3-(4-Chlorophenyl)-3-oxoprop-1-en-2-yl]pyrimidin-4(3H)-one

Suppliers and Price of 4(3H)-Pyrimidinone, 3-(1-(4-chlorobenzoyl)ethenyl)-

Supply Marketing:

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

Manufacturers and distributors:

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Total 0 raw suppliers

Chemical Property of 4(3H)-Pyrimidinone, 3-(1-(4-chlorobenzoyl)ethenyl)-

Chemical Property:

Vapor Pressure:1.24E-07mmHg at 25°C
Boiling Point:431°Cat760mmHg
Flash Point:214.5°C
Density:1.28g/cm³
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:260.0352552
Heavy Atom Count:18
Complexity:434

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=C(C(=O)C1=CC=C(C=C1)Cl)N2C=NC=CC2=O

Technology Process of 4(3H)-Pyrimidinone, 3-(1-(4-chlorobenzoyl)ethenyl)-

There total 2 articles about 4(3H)-Pyrimidinone, 3-(1-(4-chlorobenzoyl)ethenyl)- 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:

: 536-38-9
4-chlorobenzoylmethyl bromide

: 108664-29-5
3-[1-(4-Chloro-benzoyl)-vinyl]-3H-pyrimidin-4-one

Guidance literature:: Multi-step reaction with 2 steps

1: NaH / tetrahydrofuran / 0.5 h / Ambient temperature

2: acetic anhydride / 0.25 h / 40 °C

With acetic anhydride; sodium hydride; In tetrahydrofuran;
DOI:10.1021/jm00391a037