N,N-dibutyl-4-ethynylaniline

Base Information

Chemical Name:N,N-dibutyl-4-ethynylaniline
CAS No.:41876-68-0
Molecular Formula:C16H23N
Molecular Weight:229.365
Hs Code.:
European Community (EC) Number:834-447-5
DSSTox Substance ID:DTXSID40482326
Nikkaji Number:J1.054.186G
Wikidata:Q82318531
Mol file:41876-68-0.mol

Synonyms:N,N-dibutyl-4-ethynylaniline;41876-68-0;4-ethynyl-N,N-dibutylaniline;SCHEMBL560649;DTXSID40482326;GYEJUFWGFHPFAR-UHFFFAOYSA-N;p-(N,N-di-n-butylamino)phenylacetylene;EN300-6497044

Suppliers and Price of N,N-dibutyl-4-ethynylaniline

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
4-Ethynyl-N,N-dibutylaniline
1g
$ 829.00

AK Scientific
4-Ethynyl-N,N-dibutylaniline
100mg
$ 322.00

Total 1 raw suppliers

Chemical Property of N,N-dibutyl-4-ethynylaniline

Chemical Property:

Boiling Point:110 °C(Press: 0.5 Torr)
PSA：3.24000
Density:0.93±0.1 g/cm3(Predicted)
LogP:4.07450
XLogP3:4.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:8
Exact Mass:229.183049738
Heavy Atom Count:17
Complexity:221

Purity/Quality:: 4-Ethynyl-N,N-dibutylaniline ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCCN(CCCC)C1=CC=C(C=C1)C#C

Technology Process of N,N-dibutyl-4-ethynylaniline

There total 7 articles about N,N-dibutyl-4-ethynylaniline 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: 100.0%

: 667865-53-4
N,N-dibutyl-4-[(trimethylsilyl)ethynyl]aniline

: 41876-68-0
(4-di-n-butylamino)phenylacetylene

Guidance literature:: With potassium hydroxide; In methanol; water; at 40 ℃; for 0.5h;

Reference yield: 87.0%

: 1185275-28-8
4-(4-(N,N-dibutylamino)phenyl)-2-methylbut-3-yn-2-ol

: 41876-68-0
(4-di-n-butylamino)phenylacetylene

: 67-64-1
acetone

Guidance literature:: With potassium hydroxide; In toluene; Inert atmosphere; Reflux;
DOI:10.1002/pola.24806

Reference yield: 84.5%

: 109-65-9
1-bromo-butane

: 540-37-4
p-aminoiodobenzene

: 1066-54-2
trimethylsilylacetylene

: 41876-68-0
(4-di-n-butylamino)phenylacetylene

Guidance literature:: 1-bromo-butane; p-aminoiodobenzene; With potassium carbonate; potassium iodide; In N,N-dimethyl-formamide; at 100 ℃; for 10h; Inert atmosphere;

With triethylamine; In tetrahydrofuran; for 0.833333h; Inert atmosphere;

trimethylsilylacetylene; Further stages;