1-(7-Bromo-3,4-dihydroisoquinolin-2(1H)-YL)ethanone

Base Information

Chemical Name:1-(7-Bromo-3,4-dihydroisoquinolin-2(1H)-YL)ethanone
CAS No.:937591-28-1
Molecular Formula:C₁₁H₁₂BrNO
Molecular Weight:254.126
Hs Code.:
European Community (EC) Number:837-282-7
DSSTox Substance ID:DTXSID90587815
Wikidata:Q82480308
Mol file:937591-28-1.mol

Synonyms:937591-28-1;1-(7-BROMO-3,4-DIHYDROISOQUINOLIN-2(1H)-YL)ETHANONE;1-(7-Bromo-1,2,3,4-tetrahydroisoquinolin-2-yl)ethan-1-one;1-(7-bromo-3,4-dihydro-1H-isoquinolin-2-yl)ethanone;SCHEMBL4518190;DTXSID90587815;TVMHENWABNGYNH-UHFFFAOYSA-N;DB-336837;CS-0249361;EN300-4322988;2-Acetyl-7-bromo-1,2,3,4-tetrahydroisoquinoline;Z1416174048;1-(7-Bromo-3,4-dihydroisoquinolin-2(1H)-yl)ethan-1-one

Suppliers and Price of 1-(7-Bromo-3,4-dihydroisoquinolin-2(1H)-YL)ethanone

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

AK Scientific
1-(7-Bromo-3,4-dihydroisoquinolin-2(1H)-YL)ethanone
1g
$ 773.00

AK Scientific
1-(7-Bromo-3,4-dihydroisoquinolin-2(1H)-YL)ethanone
100mg
$ 289.00

Total 2 raw suppliers

Chemical Property of 1-(7-Bromo-3,4-dihydroisoquinolin-2(1H)-YL)ethanone

Chemical Property:

PSA：20.31000
LogP:2.29160
XLogP3:1.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:253.01023
Heavy Atom Count:14
Complexity:231

Purity/Quality:

99% ^*data from raw suppliers

1-(7-Bromo-3,4-dihydroisoquinolin-2(1H)-YL)ethanone ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)N1CCC2=C(C1)C=C(C=C2)Br

Technology Process of 1-(7-Bromo-3,4-dihydroisoquinolin-2(1H)-YL)ethanone

There total 2 articles about 1-(7-Bromo-3,4-dihydroisoquinolin-2(1H)-YL)ethanone 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: 99.0%

: 17680-55-6
7-bromo-1,2,3,4-tetrahydroisoquinoline

: 108-24-7
acetic anhydride

: 937591-28-1
1-(7-bromo-3,4-dihydroisoquinolin-2(1H)-yl)ethanone

Guidance literature:: With dmap; triethylamine; In dichloromethane; at 0 - 20 ℃; for 15h;

Reference yield: 83.0%

: 17680-55-6
7-bromo-1,2,3,4-tetrahydroisoquinoline

: 75-36-5
acetyl chloride

: 937591-28-1
1-(7-bromo-3,4-dihydroisoquinolin-2(1H)-yl)ethanone

Guidance literature:: With triethylamine; In dichloromethane; at 0 ℃; for 2h;

Reference yield: 70.0%

: 937591-28-1
1-(7-bromo-3,4-dihydroisoquinolin-2(1H)-yl)ethanone

: 73183-34-3
bis(pinacol)diborane

: 937591-29-2
1-(7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)ethanone

Guidance literature:: With potassium acetate; dichloro(1,1'-bis(diphenylphosphanyl)ferrocene)palladium(II)*CH₂Cl₂; In 1,2-dimethoxyethane; at 150 ℃; for 0.25h; Microwave;