3-(Phenylethynyl)aniline

Base Information

Chemical Name:3-(Phenylethynyl)aniline
CAS No.:51624-44-3
Molecular Formula:C14H11N
Molecular Weight:193.248
Hs Code.:2921420090
European Community (EC) Number:690-090-3
DSSTox Substance ID:DTXSID00540613
Nikkaji Number:J651.079E
Wikidata:Q82416669
Mol file:51624-44-3.mol

Synonyms:3-(phenylethynyl)aniline;51624-44-3;3-(2-phenylethynyl)aniline;Benzenamine, 3-(phenylethynyl)-;3-phenylethynylaniline;3-phenylethynyl aniline;3-Phenylethynyl-phenylamine;SCHEMBL2811255;DTXSID00540613;BOKCJGOOHNNDCL-UHFFFAOYSA-N;BCA62444;MFCD08701708;AKOS000118105;NCGC00320405-01;AS-60632;CS-0059701;EN300-27443;W18181;AB01144078-03;F2167-5398;Z235348221

Suppliers and Price of 3-(Phenylethynyl)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

TRC
3-(2-phenylethynyl)aniline
50mg
$ 155.00

Rieke Metals
3-Phenylethynyl-phenylamine
1g
$ 661.00

Rieke Metals
3-Phenylethynyl-phenylamine
5g
$ 1728.00

American Custom Chemicals Corporation
3-(PHENYLETHYNYL)ANILINE 95.00%
5G
$ 1928.08

American Custom Chemicals Corporation
3-(PHENYLETHYNYL)ANILINE 95.00%
2.5G
$ 1473.14

American Custom Chemicals Corporation
3-(PHENYLETHYNYL)ANILINE 95.00%
1G
$ 983.52

AK Scientific
3-(phenylethynyl)aniline
1g
$ 590.00

Total 4 raw suppliers

Chemical Property of 3-(Phenylethynyl)aniline

Chemical Property:

PSA：26.02000
LogP:3.24980
XLogP3:3.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:193.089149355
Heavy Atom Count:15
Complexity:251

Purity/Quality:

99% ^*data from raw suppliers

3-(2-phenylethynyl)aniline ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 3-(Phenylethynyl)aniline

There total 19 articles about 3-(Phenylethynyl)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: 95.0%

: 536-74-3
phenylacetylene

: 626-01-7
3-Iodoaniline

: 51624-44-3
1-(3-aminophenyl)-2-phenylacetylene

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; diisopropylamine; In tetrahydrofuran; at 20 ℃; for 1h;
DOI:10.1016/S0022-328X(02)01322-0

Reference yield: 95.0%

: 591-50-4
iodobenzene

: 54060-30-9
3-acetylenephenylamine

: 51624-44-3
1-(3-aminophenyl)-2-phenylacetylene

Guidance literature:: With triethylamine; at 80 ℃; for 12h; Ionic liquid;
DOI:10.1016/j.molcata.2010.10.015

Reference yield: 90.0%

: 626-01-7
3-Iodoaniline

: 637-44-5
phenylpropyolic acid

: 51624-44-3
1-(3-aminophenyl)-2-phenylacetylene

Guidance literature:: With copper(l) iodide; 1,10-Phenanthroline; caesium carbonate; In N,N-dimethyl-formamide; at 130 ℃; for 24h; Inert atmosphere;
DOI:10.1039/c0cc03772a