Propanenitrile, 3,3',3''-nitrilotris-

Base Information

Chemical Name:Propanenitrile, 3,3',3''-nitrilotris-
CAS No.:7528-78-1
Deprecated CAS:111216-38-7
Molecular Formula:C9H12 N4
Molecular Weight:176.221
Hs Code.:2926909090
European Community (EC) Number:678-643-7
NSC Number:61541
UNII:XF7HFR7YMX
DSSTox Substance ID:DTXSID7064732
Nikkaji Number:J421.865E
Wikidata:Q81991781
Mol file:7528-78-1.mol

Synonyms:7528-78-1;Tris(2-cyanoethyl)amine;Propanenitrile, 3,3',3''-nitrilotris-;3-[bis(2-cyanoethyl)amino]propanenitrile;3,3',3''-Nitrilotripropanenitrile;3,3,3-Nitrilotripropionitrile;3,3',3''-Nitrilotripropionitrile;Propionitrile, 3,3',3''-nitrilotri-;Tris(beta-cyanoethyl)amine;XF7HFR7YMX;NSC 61541;NSC-61541;3-(bis(2-cyanoethyl)amino)propanenitrile;NSC61541;Nitrilotripropionitril;UNII-XF7HFR7YMX;SCHEMBL65032;Amine, tris(2-cyanoethyl)-;3,3''-Nitrilotripropionitrile;3,3,3-Nitrilotripropanenitrile;DTXSID7064732;FYYPYNRGACGNNN-UHFFFAOYSA-;Propionitrile,3',3''-nitrilotri-;MFCD00671575;Propanenitrile,3',3''-nitrilotris-;AKOS015836378;3,3',3''-Nitrilotris[propanenitrile];TRIS(2-CYANOETHYL)AMINE 99+%;AS-75593;CS-0158482;T1577

Suppliers and Price of Propanenitrile, 3,3',3''-nitrilotris-

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

TCI Chemical
Tris(2-cyanoethyl)amine >99.0%(T)
25g
$ 129.00

TCI Chemical
Tris(2-cyanoethyl)amine >99.0%(T)
5g
$ 43.00

Matrix Scientific
3-[Bis(2-cyanoethyl)amino]propanenitrile
1g
$ 316.00

Matrix Scientific
3-[Bis(2-cyanoethyl)amino]propanenitrile
10g
$ 1170.00

Matrix Scientific
3-[Bis(2-cyanoethyl)amino]propanenitrile
5g
$ 810.00

Crysdot
3,3',3''-Nitrilotripropanenitrile 97%
10g
$ 350.00

Crysdot
3,3',3''-Nitrilotripropanenitrile 97%
5g
$ 210.00

Crysdot
3,3',3''-Nitrilotripropanenitrile 97%
1g
$ 70.00

American Custom Chemicals Corporation
TRIS(2-CYANOETHYL)AMINE 95.00%
5MG
$ 495.64

AK Scientific
Tris(2-cyanoethyl)amine
5g
$ 264.00

Total 16 raw suppliers

Chemical Property of Propanenitrile, 3,3',3''-nitrilotris-

Chemical Property:

Melting Point:60 °C
Boiling Point:140 °C / 10mmHg
PSA：74.61000
LogP:1.02944
Storage Temp.:Sealed in dry,Room Temperature
Solubility.:soluble in Methanol
XLogP3:-0.7
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:176.106196400
Heavy Atom Count:13
Complexity:220

Purity/Quality:

97% ^*data from raw suppliers

Tris(2-cyanoethyl)amine >99.0%(T) ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C(CN(CCC#N)CCC#N)C#N

Technology Process of Propanenitrile, 3,3',3''-nitrilotris-

There total 2 articles about Propanenitrile, 3,3',3''-nitrilotris- 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:

: 107-13-1,25014-41-9
acrylonitrile

: 151-18-8,60585-38-8
2-cyanoethylamine

: 7528-78-1
tris(2-cyanoethyl)amine

: 111-94-4
3,3'-Iminodipropionitrile

Guidance literature:: With Pd(2,6-(Cy₂PCH₂)₂C₆H₃)(OTf); ammonia; In benzene-d6; at 60 ℃; for 12h;
DOI:10.1016/j.crci.2015.12.008

Reference yield:

: 7664-41-7
ammonia

: 107-13-1,25014-41-9
acrylonitrile

: 151-18-8,60585-38-8
2-cyanoethylamine

: 7528-78-1
tris(2-cyanoethyl)amine

: 111-94-4
3,3'-Iminodipropionitrile

Guidance literature:: DOI:10.1021/ja01233a019

Reference yield:

: 7528-78-1
tris(2-cyanoethyl)amine

: 3,3'-((benzoyloxy)azanediyl)dipropanenitrile

Guidance literature:: Multi-step reaction with 2 steps

1: 3-chloro-benzenecarboperoxoic acid / dichloromethane / 12 h / -78 - 25 °C / Inert atmosphere

2: dmap; triethylamine / dichloromethane / 1 h / 0 °C / Inert atmosphere

With dmap; triethylamine; 3-chloro-benzenecarboperoxoic acid; In dichloromethane;
DOI:10.1021/acs.orglett.0c00297