Benzeneethanaminium, 4-bromo-N-(2-hydroxy-3-(2-(2-propenyl)phenoxy)propyl)-N,N-dimethyl-beta-oxo-, bromide

Base Information

Chemical Name:Benzeneethanaminium, 4-bromo-N-(2-hydroxy-3-(2-(2-propenyl)phenoxy)propyl)-N,N-dimethyl-beta-oxo-, bromide
CAS No.:105996-44-9
Molecular Formula:Br*C₂₂H₂₇BrNO₃
Molecular Weight:513.269
Hs Code.:
DSSTox Substance ID:DTXSID30909855

Synonyms:105996-44-9;Benzeneethanaminium, 4-bromo-N-(2-hydroxy-3-(2-(2-propenyl)phenoxy)propyl)-N,N-dimethyl-beta-oxo-, bromide;C22H27BrNO3.Br;C22-H27-Br-N-O3.Br;DTXSID30909855;LS-30242;N-[2-(4-Bromophenyl)-2-oxoethyl]-2-hydroxy-N,N-dimethyl-3-[2-(prop-2-en-1-yl)phenoxy]propan-1-aminium bromide

Suppliers and Price of Benzeneethanaminium, 4-bromo-N-(2-hydroxy-3-(2-(2-propenyl)phenoxy)propyl)-N,N-dimethyl-beta-oxo-, bromide

Supply Marketing:

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

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Chemical Property of Benzeneethanaminium, 4-bromo-N-(2-hydroxy-3-(2-(2-propenyl)phenoxy)propyl)-N,N-dimethyl-beta-oxo-, bromide

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
Density:g/cm³
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:10
Exact Mass:513.03372
Heavy Atom Count:28
Complexity:474

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C[N+](C)(CC(COC1=CC=CC=C1CC=C)O)CC(=O)C2=CC=C(C=C2)Br.[Br-]

Technology Process of Benzeneethanaminium, 4-bromo-N-(2-hydroxy-3-(2-(2-propenyl)phenoxy)propyl)-N,N-dimethyl-beta-oxo-, bromide

There total 3 articles about Benzeneethanaminium, 4-bromo-N-(2-hydroxy-3-(2-(2-propenyl)phenoxy)propyl)-N,N-dimethyl-beta-oxo-, bromide 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: 65.0%

: 105996-36-9
dl-1-(2-Allylphenoxy)-2-hydroxy-3-dimethylaminopropane

: 99-73-0,132309-76-3
para-bromophenacyl bromide

: 105996-44-9
[3-(2-Allyl-phenoxy)-2-hydroxy-propyl]-[2-(4-bromo-phenyl)-2-oxo-ethyl]-dimethyl-ammonium; bromide

Guidance literature:: In butanone; Heating;
DOI:10.1007/BF00758612

Reference yield:

: 1745-81-9
o-Allylphenol

: 105996-44-9
[3-(2-Allyl-phenoxy)-2-hydroxy-propyl]-[2-(4-bromo-phenyl)-2-oxo-ethyl]-dimethyl-ammonium; bromide

Guidance literature:: Multi-step reaction with 3 steps

1: NaOH / H₂O

2: 57 percent / aq. ethanol

3: 65 percent / butan-2-one / Heating

With sodium hydroxide; In ethanol; water; butanone;
DOI:10.1007/BF00758612

Reference yield:

: 4638-04-4
1-(2-allylphenoxy)-2,3-epoxypropane

: 105996-44-9
[3-(2-Allyl-phenoxy)-2-hydroxy-propyl]-[2-(4-bromo-phenyl)-2-oxo-ethyl]-dimethyl-ammonium; bromide

Guidance literature:: Multi-step reaction with 2 steps

1: 57 percent / aq. ethanol

2: 65 percent / butan-2-one / Heating

In ethanol; butanone;
DOI:10.1007/BF00758612