3-[(4-Fluorophenyl)ethynyl]aniline

Base Information

Chemical Name:3-[(4-Fluorophenyl)ethynyl]aniline
CAS No.:138781-97-2
Molecular Formula:C₁₄H₁₀FN
Molecular Weight:211.239
Hs Code.:
ChEMBL ID:CHEMBL3828204
DSSTox Substance ID:DTXSID30600991
Wikidata:Q82497350
Mol file:138781-97-2.mol

Synonyms:138781-97-2;3-[(4-Fluorophenyl)ethynyl]aniline;3-[2-(4-FLUOROPHENYL)ETHYNYL]ANILINE;Benzenamine, 3-[2-(4-fluorophenyl)ethynyl]-;3-(4-Fluoro-phenylethynyl)-phenylamine;SCHEMBL9195087;CHEMBL3828204;DTXSID30600991;XBKVTMPLFNPJLY-UHFFFAOYSA-N;MFCD12156106

Suppliers and Price of 3-[(4-Fluorophenyl)ethynyl]aniline

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

Rieke Metals
3-(4-Fluoro-phenylethynyl)-phenylamine
5g
$ 1728.00

Rieke Metals
3-(4-Fluoro-phenylethynyl)-phenylamine
1g
$ 661.00

Total 1 raw suppliers

Chemical Property of 3-[(4-Fluorophenyl)ethynyl]aniline

Chemical Property:

PSA：26.02000
LogP:3.38890
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:211.079727485
Heavy Atom Count:16
Complexity:280

Purity/Quality:: 3-(4-Fluoro-phenylethynyl)-phenylamine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)N)C#CC2=CC=C(C=C2)F

Technology Process of 3-[(4-Fluorophenyl)ethynyl]aniline

There total 2 articles about 3-[(4-Fluorophenyl)ethynyl]aniline 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: 96.0%

: bis(triphenylphosphine)palladium(II) dichloride

: 54060-30-9
3-acetylenephenylamine

: 460-00-4
1-Bromo-4-fluorobenzene

: 138781-97-2
3-((4-fluorophenyl)ethynyl)aniline

Guidance literature:: With copper(I) iodide; triphenylphosphine; In toluene;

Reference yield: 83.0%

: 352-34-1
4-fluoro-1-iodobenzene

: 54060-30-9
3-acetylenephenylamine

: 138781-97-2
3-((4-fluorophenyl)ethynyl)aniline

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; diisopropylamine; triphenylphosphine; at 20 ℃; for 16h; Schlenk technique; Sealed tube; Inert atmosphere;
DOI:10.1016/j.ejmech.2016.04.030