9-Octadecenamide, N-(2-((2-aminoethyl)amino)ethyl)-, (9Z)-

Base Information

• Chemical Name: 9-Octadecenamide, N-(2-((2-aminoethyl)amino)ethyl)-, (9Z)-
• CAS No.: 15566-80-0
• Deprecated CAS: 1846552-68-8
• Molecular Formula: C₂₂H₄₅N₃O
• Molecular Weight: 367.619
• European Community (EC) Number: 239-614-0
• DSSTox Substance ID: DTXSID40884523
• Nikkaji Number: J317.909E
• Wikidata: Q76327675
• Mol file: 15566-80-0.mol

Synonyms:15566-80-0;Oleic acid, diethylenetriamine amide;(Z)-N-[2-(2-aminoethylamino)ethyl]octadec-9-enamide;9-Octadecenamide, N-(2-((2-aminoethyl)amino)ethyl)-, (9Z)-;EINECS 239-614-0;9-Octadecenamide, N-[2-[(2-aminoethyl)amino]ethyl]-, (9Z)-;N-[2-[(2-Aminoethyl)amino]ethyl]oleic amide;(Z)-N-(2-((2-Aminoethyl)amino)ethyl)-9-octadecenamide;(Z)-N-[2-[(2-aminoethyl)amino]ethyl]-9-octadecenamide;9-Octadecenamide, N-(2-((2-aminoethyl)amino)ethyl)-, (Z)-;9-Octadecenamide, N-[2-[(2-aminoethyl)amino]ethyl]-, (Z)-;SCHEMBL11898873;C22H45N3O;DTXSID40884523;C22-H45-N3-O

Chemical Property of 9-Octadecenamide, N-(2-((2-aminoethyl)amino)ethyl)-, (9Z)-

Chemical Property:

• Vapor Pressure: 1.54E-11mmHg at 25°C
• Boiling Point: 535.5°Cat760mmHg
• Flash Point: 277.6°C
• PSA: 70.64000
• Density: 0.91g/cm³
• LogP: 6.61990
• XLogP3: 5.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 20
• Exact Mass: 367.35626307
• Heavy Atom Count: 26
• Complexity: 319

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CCCCCCCCC(=O)NCCNCCN
• Isomeric SMILES: CCCCCCCC/C=C\CCCCCCCC(=O)NCCNCCN

Technology Process of 9-Octadecenamide, N-(2-((2-aminoethyl)amino)ethyl)-, (9Z)-

There total 2 articles about 9-Octadecenamide, N-(2-((2-aminoethyl)amino)ethyl)-, (9Z)- 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: 36.0%

(Z)-9-octadecenoyl chloride (112-77-6) + 3-azapentane-1,5-diamine (111-40-0,98824-35-2) → N-[2-[(2-aminoethyl)amino]ethyl]oleylamide (15566-80-0)

Guidance literature:

3-azapentane-1,5-diamine; With Benzophenone imine; In dichloromethane; at 20 ℃;

(Z)-9-octadecenoyl chloride; With triethylamine; dmap;

DOI:10.1128/AAC.49.6.2307-2313.2005

Reference yield:

cis-Octadecenoic acid (112-80-1,2027-47-6) + 3-azapentane-1,5-diamine (111-40-0,98824-35-2) → N-[2-[(2-aminoethyl)amino]ethyl]oleylamide (15566-80-0)

Guidance literature:

In 5,5-dimethyl-1,3-cyclohexadiene; at 140 ℃; for 2.5h;

DOI:10.1007/s11743-009-1168-9

upstream raw materials:

(Z)-9-octadecenoyl chloride

3-azapentane-1,5-diamine

cis-Octadecenoic acid