1-Bromo-4-[(3-phenylprop-2-yn-1-yl)oxy]benzene

Base Information

Chemical Name:1-Bromo-4-[(3-phenylprop-2-yn-1-yl)oxy]benzene
CAS No.:154884-64-7
Molecular Formula:C15H11BrO
Molecular Weight:287.156
Hs Code.:
DSSTox Substance ID:DTXSID50573496
Wikidata:Q82462233
Mol file:154884-64-7.mol

Synonyms:154884-64-7;1-Bromo-4-[(3-phenylprop-2-yn-1-yl)oxy]benzene;DTXSID50573496;AKOS011623836

Suppliers and Price of 1-Bromo-4-[(3-phenylprop-2-yn-1-yl)oxy]benzene

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

Total 1 raw suppliers

Chemical Property of 1-Bromo-4-[(3-phenylprop-2-yn-1-yl)oxy]benzene

Chemical Property:

Boiling Point:395.2±22.0 °C(Predicted)
PSA：9.23000
Density:1.42±0.1 g/cm3(Predicted)
LogP:3.87960
XLogP3:4.5
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:3
Exact Mass:285.99933
Heavy Atom Count:17
Complexity:274

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C#CCOC2=CC=C(C=C2)Br

Technology Process of 1-Bromo-4-[(3-phenylprop-2-yn-1-yl)oxy]benzene

There total 3 articles about 1-Bromo-4-[(3-phenylprop-2-yn-1-yl)oxy]benzene 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: 72.0%

: 591-50-4
iodobenzene

: 33133-45-8
1-bromo-4-(prop-2-ynyloxy)benzene

: 154884-64-7
1-bromo-4-(3-phenylprop-2-ynyloxy)benzene

Guidance literature:: With piperidine; copper(l) iodide; dichlorobis(tri-O-tolylphosphine)palladium; triphenylphosphine; at 20 ℃; for 4h; Inert atmosphere;
DOI:10.1039/c2cc32715e

Reference yield:

: 1504-58-1
3-Phenyl-2-propyn-1-ol

: 139139-81-4
bis(4-bromophenyl)iodonium triflate

: 154884-64-7
1-bromo-4-(3-phenylprop-2-ynyloxy)benzene

Guidance literature:: With magnesium sulfate; sodium t-butanolate; In 1,2-dichloro-ethane; benzene; at 0 - 60 ℃; for 3h; Inert atmosphere;
DOI:10.1021/acs.orglett.5b03651

Reference yield:

: 106-41-2
4-bromo-phenol

: 154884-64-7
1-bromo-4-(3-phenylprop-2-ynyloxy)benzene

Guidance literature:: Multi-step reaction with 2 steps

1.1: potassium carbonate / 0.5 h / 20 °C

1.2: 20 °C

2.1: bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; triethylamine / 0.17 h / 20 °C / Inert atmosphere

2.2: 20 °C / Inert atmosphere

With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; potassium carbonate; triethylamine; 2.1: |Sonogashira Cross-Coupling / 2.2: |Sonogashira Cross-Coupling;
DOI:10.1002/adsc.201700534