4-Acetyl-4-(2-cyanoethyl)heptanedinitrile

Base Information

Chemical Name:4-Acetyl-4-(2-cyanoethyl)heptanedinitrile
CAS No.:126-50-1
Molecular Formula:C12H15 N3 O
Molecular Weight:217.271
Hs Code.:2926909090
European Community (EC) Number:204-787-3
NSC Number:680511,147707
UNII:M2YBH5Y6K7
DSSTox Substance ID:DTXSID90155038
Nikkaji Number:J49.278G
Wikidata:Q83022642
Mol file:126-50-1.mol

Synonyms:4-Acetyl-4-(2-cyanoethyl)heptanedinitrile;126-50-1;USAF B-122;1,1,1-Tris(2-cyanoethyl)acetone;NSC 147707;1,1,1-Tris(2-cyanoethyl)-2-propanone;4-Acetyl-4-(2cyanoethylheptane)dinitrile;Heptanedinitrile, 4-acetyl-4-(2-cyanoethyl)-;EINECS 204-787-3;1,1,1-Tris(beta-cyanoethyl)acetone;BRN 1782506;M2YBH5Y6K7;Heptane, 4-acetyl-4-(2-cyanoethyl)-1,7-dinitrilo-;NSC680511;NSC-147707;NSC-680511;1,7-HEPTANEDINITRILE, 4-ACETYL-4-(2-CYANOETHYL)-;3-03-00-01439 (Beilstein Handbook Reference);NSC147707;Heptane,7-dinitrilo-;starbld0011199;UNII-M2YBH5Y6K7;1,1-Tris-cyanoethylacetone;1,1-Tris(2-cyanoethyl)acetone;SCHEMBL11509637;DTXSID90155038;1, 4-acetyl-4-(2-cyanoethyl)-;1,1-Tris(.beta.-cyanoethyl)acetone;MFCD01723843;1,1-Tris(2-cyanoethyl)-2-propanone;AKOS024254548;1,1,1-Tris(.beta.-cyanoethyl)acetone;WLN: NC2XV1 & 2CN & 2CN;LS-74316;NS-02534

Suppliers and Price of 4-Acetyl-4-(2-cyanoethyl)heptanedinitrile

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
4-ACETYL-4-(2-CYANOETHYL)HEPTANEDINITRILE 95.00%
5MG
$ 495.59

Total 10 raw suppliers

Chemical Property of 4-Acetyl-4-(2-cyanoethyl)heptanedinitrile

Chemical Property:

Vapor Pressure:3.7E-10mmHg at 25°C
Melting Point:154 °C
Boiling Point:500.7°Cat760mmHg
Flash Point:256.6°C
PSA：88.44000
Density:1.065g/cm³
LogP:2.47314
XLogP3:-0.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:217.121512110
Heavy Atom Count:16
Complexity:334

Purity/Quality:

98%min ^*data from raw suppliers

4-ACETYL-4-(2-CYANOETHYL)HEPTANEDINITRILE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)C(CCC#N)(CCC#N)CCC#N

Technology Process of 4-Acetyl-4-(2-cyanoethyl)heptanedinitrile

There total 6 articles about 4-Acetyl-4-(2-cyanoethyl)heptanedinitrile 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: