2-[(4-Nitrophenyl)ethynyl]aniline

Base Information

Chemical Name:2-[(4-Nitrophenyl)ethynyl]aniline
CAS No.:157869-12-0
Molecular Formula:C14H10N2O2
Molecular Weight:238.246
Hs Code.:
DSSTox Substance ID:DTXSID90358502
Nikkaji Number:J583.487B
Wikidata:Q82139118
ChEMBL ID:CHEMBL1730590
Mol file:157869-12-0.mol

Synonyms:2-[2-(4-nitrophenyl)ethynyl]aniline;2-[(4-nitrophenyl)ethynyl]aniline;157869-12-0;MLS001178776;SMR000476406;cid_900949;CHEMBL1730590;BDBM76613;DTXSID90358502;o-(4-nitrophenyl-ethynyl)aniline;HMS2778J23;AKOS024367866;[2-[2-(4-nitrophenyl)ethynyl]phenyl]amine

Suppliers and Price of 2-[(4-Nitrophenyl)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

Total 1 raw suppliers

Chemical Property of 2-[(4-Nitrophenyl)ethynyl]aniline

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:238.074227566
Heavy Atom Count:18
Complexity:355

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C(=C1)C#CC2=CC=C(C=C2)[N+](=O)[O-])N

Technology Process of 2-[(4-Nitrophenyl)ethynyl]aniline

There total 5 articles about 2-[(4-Nitrophenyl)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: 99.0%

: 636-98-6
p-nitrobenzene iodide

: 52670-38-9
2-ethynylaniline

: 157869-12-0
ortho-(4-nitrophenylethynyl)aniline

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; triethylamine; at 20 - 50 ℃; Inert atmosphere; Schlenk technique;
DOI:10.1002/anie.201305579

Reference yield: 95.0%

: 937-31-5
(4-Nitrophenyl)acetylene

: 615-43-0
2-iodophenylamine

: 157869-12-0
ortho-(4-nitrophenylethynyl)aniline

Guidance literature:: With tetrakis(acetonitrile)copper(I) perchlorate; 2,5-bis(2-(diphenylphosphino)5-methoxyphenyl)-1,3,4-oxadiazole; potassium carbonate; In 1,4-dioxane; Reagent/catalyst; Catalytic behavior; Reflux; Inert atmosphere; Schlenk technique;
DOI:10.1002/aoc.3124

Reference yield: 89.0%

: 937-31-5
(4-Nitrophenyl)acetylene

: 62-53-3
aniline

: 157869-12-0
ortho-(4-nitrophenylethynyl)aniline

Guidance literature:: With bis-triphenylphosphine-palladium(II) chloride; copper(l) iodide; triethylamine; at 20 ℃; for 2h; Sealed tube; Inert atmosphere;
DOI:10.1021/acs.orglett.0c04186