6-Bromo-1-(4-methoxyphenyl)hexan-1-one

Base Information

Chemical Name:6-Bromo-1-(4-methoxyphenyl)hexan-1-one
CAS No.:57840-61-6
Molecular Formula:C13H17BrO2
Molecular Weight:285.181
Hs Code.:
DSSTox Substance ID:DTXSID10442553
Nikkaji Number:J1.560.733E
Wikidata:Q82259888

Synonyms:6-bromo-1-(4-methoxyphenyl)hexan-1-one;57840-61-6;1-Hexanone, 6-bromo-1-(4-methoxyphenyl)-;SCHEMBL7392111;DTXSID10442553;XNUYJWLMHTZQQW-UHFFFAOYSA-N;1-(4-Methoxyphenyl)-6-bromo-1-hexanone;6-bromo-1-(4-methoxyphenyl)-1-hexanone

Suppliers and Price of 6-Bromo-1-(4-methoxyphenyl)hexan-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 6-Bromo-1-(4-methoxyphenyl)hexan-1-one

Chemical Property:

XLogP3:3.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:7
Exact Mass:284.04119
Heavy Atom Count:16
Complexity:198

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC1=CC=C(C=C1)C(=O)CCCCCBr

Technology Process of 6-Bromo-1-(4-methoxyphenyl)hexan-1-one

There total 4 articles about 6-Bromo-1-(4-methoxyphenyl)hexan-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: 87.0%

: 22809-37-6
6-bromohexanoyl chloride

: 100-66-3
methoxybenzene

: 57840-61-6
6-bromo-1-(4-methoxyphenyl)-1-hexanone

Guidance literature:: With aluminium trichloride; In 1,2-dichloro-ethane; at -15 ℃; for 1h;
DOI:10.1016/S0968-0896(00)00226-1

Reference yield:

: 6-bromo-1-fluoro-1-(p-methoxyphenyl)-1-hexene

: 57840-61-6
6-bromo-1-(4-methoxyphenyl)-1-hexanone

Guidance literature:: With water; In chloroform-d1;
DOI:10.2533/000942904777678217

Reference yield:

: 20758-60-5
1-(4-methoxyphenyl)cyclohexene

: 57840-61-6
6-bromo-1-(4-methoxyphenyl)-1-hexanone

Guidance literature:: Multi-step reaction with 2 steps

1: N-Bromosuccinimide; water / acetone / 0 - 20 °C

2: [Ir(2-(2,4-difluorophenyl)-5-(trifluoromethyl)pyridine)₂(5,5'-bis(trifluoromethyl)-2,2'-bipyridyl)](PF₆); 2,3,5-trimethyl-pyridine; thiophenol / dichloromethane / 20 °C / Sealed tube; Inert atmosphere; Irradiation

With 2,3,5-trimethyl-pyridine; N-Bromosuccinimide; [Ir(2-(2,4-difluorophenyl)-5-(trifluoromethyl)pyridine)₂(5,5'-bis(trifluoromethyl)-2,2'-bipyridyl)](PF₆); water; thiophenol; In dichloromethane; acetone;
DOI:10.1021/jacs.6b06517