1-(Phenylethynyl)isoquinoline

Base Information

Chemical Name:1-(Phenylethynyl)isoquinoline
CAS No.:70437-09-1
Molecular Formula:C17H11N
Molecular Weight:229.281
Hs Code.:
DSSTox Substance ID:DTXSID10473569
Nikkaji Number:J2.072.678D
Wikidata:Q82303056

Synonyms:1-(Phenylethynyl)isoquinoline;70437-09-1;Isoquinoline, 1-(phenylethynyl)-;1-phenylethynylisoquinoline;SCHEMBL15940603;DTXSID10473569

Suppliers and Price of 1-(Phenylethynyl)isoquinoline

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 4 raw suppliers

Chemical Property of 1-(Phenylethynyl)isoquinoline

Chemical Property:

XLogP3:4.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:229.089149355
Heavy Atom Count:18
Complexity:328

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)C#CC2=NC=CC3=CC=CC=C32

Technology Process of 1-(Phenylethynyl)isoquinoline

There total 10 articles about 1-(Phenylethynyl)isoquinoline 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: 97.0%

: 19493-44-8
1-chloroisoquinoline

: 536-74-3
phenylacetylene

: 70437-09-1
1-(2-phenylethynyl)isoquinoline

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; triethylamine; at 80 ℃; for 18h; Inert atmosphere; Schlenk technique;
DOI:10.1002/chem.201600819

Reference yield: 91.0%

: 1532-72-5
isoquinoline N-oxide

: 2170-06-1
1-Phenyl-2-(trimethylsilyl)acetylene

: 70437-09-1
1-(2-phenylethynyl)isoquinoline

Guidance literature:: With tetrabutyl ammonium fluoride; In N,N-dimethyl-formamide; at 20 ℃; for 2h; Inert atmosphere;
DOI:10.1021/acs.orglett.9b01141

Reference yield: 71.0%

: 19658-77-6
1-iodoisoquiniline

: 13984-49-1
(phenylethynyl)zinc chloride

: 70437-09-1
1-(2-phenylethynyl)isoquinoline

Guidance literature:: With copper(l) iodide; lithium chloride; In N,N-dimethyl-formamide; at 100 ℃; for 6h; Inert atmosphere; Sealed tube;
DOI:10.1002/anie.201502379