3-[4-(4-Nitrophenyl)piperazin-1-yl]-3-oxopropanenitrile

Base Information

Chemical Name:3-[4-(4-Nitrophenyl)piperazin-1-yl]-3-oxopropanenitrile
CAS No.:122648-74-2
Molecular Formula:C13H14 N4 O3
Molecular Weight:274.2753
Hs Code.:2933599090
DSSTox Substance ID:DTXSID80397223
Wikidata:Q82198380
Mol file:122648-74-2.mol

Synonyms:3-[4-(4-nitrophenyl)piperazin-1-yl]-3-oxopropanenitrile;122648-74-2;1-Piperazinepropanenitrile, 4-(4-nitrophenyl)-beta-oxo-;Oprea1_180497;DTXSID80397223;KUMCXTMKBWPBOF-UHFFFAOYSA-N;AKOS001048039;CS-0220801;EN300-07585;Z56955975

Suppliers and Price of 3-[4-(4-Nitrophenyl)piperazin-1-yl]-3-oxopropanenitrile

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

American Custom Chemicals Corporation
3-[4-(4-NITROPHENYL)PIPERAZIN-1-YL]-3-OXOPROPANENITRILE 95.00%
5G
$ 1114.58

American Custom Chemicals Corporation
3-[4-(4-NITROPHENYL)PIPERAZIN-1-YL]-3-OXOPROPANENITRILE 95.00%
2.5G
$ 932.60

American Custom Chemicals Corporation
3-[4-(4-NITROPHENYL)PIPERAZIN-1-YL]-3-OXOPROPANENITRILE 95.00%
1G
$ 692.46

Total 3 raw suppliers

Chemical Property of 3-[4-(4-Nitrophenyl)piperazin-1-yl]-3-oxopropanenitrile

Chemical Property:

Vapor Pressure:2.95E-12mmHg at 25°C
Boiling Point:552.6°Cat760mmHg
Flash Point:288°C
PSA：93.16000
Density:1.333g/cm³
LogP:1.68318
XLogP3:1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:274.10659032
Heavy Atom Count:20
Complexity:409

Purity/Quality:

98% ^*data from raw suppliers

3-[4-(4-NITROPHENYL)PIPERAZIN-1-YL]-3-OXOPROPANENITRILE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(=O)CC#N

Technology Process of 3-[4-(4-Nitrophenyl)piperazin-1-yl]-3-oxopropanenitrile

There total 2 articles about 3-[4-(4-Nitrophenyl)piperazin-1-yl]-3-oxopropanenitrile 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:

: 6269-89-2
1-(4-Nitrophenyl)piperazine

: 122648-74-2
1-(Cyanoacetyl)-4-(4-nitrophenyl)piperazine

Guidance literature:: Multi-step reaction with 2 steps

1: Et₃N / CH₂Cl₂ / 2 h / 0 °C

2: CH₂Cl₂ / 3 h / 0 °C

With triethylamine; In dichloromethane;
DOI:10.1021/ja00201a042