1-(3-Bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene

Base Information

Chemical Name:1-(3-Bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene
CAS No.:173019-83-5
Molecular Formula:C10H6BrF3
Molecular Weight:263.057
Hs Code.:
DSSTox Substance ID:DTXSID90441160
Nikkaji Number:J2.618.248D
Wikidata:Q82257789

Synonyms:1-(3-bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene;173019-83-5;1-(3-bromoprop-1-ynyl)-4-(trifluoromethyl)benzene;F2147-0715;SCHEMBL2297359;DTXSID90441160;AKOS015958112;CS-0241740;EN300-237307;3-[4-(Trifluoromethyl)phenyl]-2-propynyl bromide;1-(3-Bromo-1-propyn-1-yl)-4-(trifluoromethyl)benzene

Suppliers and Price of 1-(3-Bromoprop-1-yn-1-yl)-4-(trifluoromethyl)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

AK Scientific
1-(3-Bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene
5g
$ 2222.00

AK Scientific
1-(3-Bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene
100mg
$ 310.00

Total 2 raw suppliers

Chemical Property of 1-(3-Bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene

Chemical Property:

PSA：0.00000
LogP:3.45180
XLogP3:3.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:261.96050
Heavy Atom Count:14
Complexity:237

Purity/Quality:

99% ^*data from raw suppliers

1-(3-Bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1C#CCBr)C(F)(F)F
Uses 1-(3-Bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene is used as a reactant in the preparation of propargyl bromide precursors to allenylcyclopropanols.

Technology Process of 1-(3-Bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene

There total 3 articles about 1-(3-Bromoprop-1-yn-1-yl)-4-(trifluoromethyl)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: 95.0%

: 173546-21-9
3-(4-trifluoromethylphenyl)prop-2-yn-1-ol

: 173019-83-5
1-(3-bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene

Guidance literature:: With bromine; triphenylphosphine; In dichloromethane; at 0 ℃;
DOI:10.1021/ja904055z

Reference yield: 73.0%

: 173019-83-5
1-(3-bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene

Guidance literature:

Reference yield:

: 455-13-0
4-Iodobenzotrifluoride

: 173019-83-5
1-(3-bromoprop-1-yn-1-yl)-4-(trifluoromethyl)benzene

Guidance literature:: Multi-step reaction with 2 steps

1: diethylamine / dichlorobis(triphenylphosphine)palladium(II), copper(I) iodide / 5 h / Ambient temperature

2: PBr₃, pyridine / diethyl ether / 2.5 h / Ambient temperature

With pyridine; phosphorus tribromide; diethylamine; bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; In diethyl ether;
DOI:10.1021/jm9706168