3-Chloro-5-(4-methoxyphenyl)cyclohex-2-en-1-one

Base Information

Chemical Name:3-Chloro-5-(4-methoxyphenyl)cyclohex-2-en-1-one
CAS No.:61888-41-3
Molecular Formula:C13H13ClO2
Molecular Weight:236.698
Hs Code.:
DSSTox Substance ID:DTXSID00384473

Synonyms:3-chloro-5-(4-methoxyphenyl)cyclohex-2-en-1-one;61888-41-3;2-Cyclohexen-1-one, 3-chloro-5-(4-methoxyphenyl)-;SCHEMBL14950837;DTXSID00384473;AKOS002681091

Suppliers and Price of 3-Chloro-5-(4-methoxyphenyl)cyclohex-2-en-1-one

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 3-Chloro-5-(4-methoxyphenyl)cyclohex-2-en-1-one

Chemical Property:

XLogP3:2.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:236.0604073
Heavy Atom Count:16
Complexity:290

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC=C(C=C1)C2CC(=CC(=O)C2)Cl

Technology Process of 3-Chloro-5-(4-methoxyphenyl)cyclohex-2-en-1-one

There total 2 articles about 3-Chloro-5-(4-methoxyphenyl)cyclohex-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: 76.0%

: 1774-12-5
5-(4-methoxyphenyl)-1,3-cyclohexanedione

: 61888-41-3
3-chloro-5-(4-methoxyphenyl)-cyclohex-2-enone

Guidance literature:: With oxalyl dichloride; N,N-dimethyl-formamide; In dichloromethane; at 0 - 20 ℃; for 2h;

Reference yield:

: 943-88-4
4-(p-methoxyphenyl)-3-butene-2-one

: 61888-41-3
3-chloro-5-(4-methoxyphenyl)-cyclohex-2-enone

Guidance literature:: Multi-step reaction with 2 steps

1: (i) NaOMe, MeOH, (ii) aq. NaOH, (iii) aq. HCl

2: POCl₃, Na₂CO₃ / toluene

With sodium carbonate; trichlorophosphate; In toluene;
DOI:10.1021/jm00215a018