Dimethyl(3-stearamidepropyl)(3-sulphonatopropyl)ammonium

Base Information

• Chemical Name: Dimethyl(3-stearamidepropyl)(3-sulphonatopropyl)ammonium
• CAS No.: 20284-67-7
• Molecular Formula: C26H54 N2 O4 S
• Molecular Weight: 490.792
• European Community (EC) Number: 243-683-2
• DSSTox Substance ID: DTXSID70174146
• Wikidata: Q83044200
• Mol file: 20284-67-7.mol

Synonyms:Dimethyl(3-stearamidepropyl)(3-sulphonatopropyl)ammonium;EINECS 243-683-2;20284-67-7;C26H54N2O4S;C26-H54-N2-O4-S;SCHEMBL1133985;DTXSID70174146;3-[N,N-Dimethyl-(3-octadecanoylaminopropyl)ammonio]-propanesulfonate;Ammonium, dimethyl(3-stearamidopropyl)(3-sulfopropyl)-, hydroxide, inner salt

Chemical Property of Dimethyl(3-stearamidepropyl)(3-sulphonatopropyl)ammonium

Chemical Property:

• PSA: 98.17000
• LogP: 7.68700
• XLogP3: 7.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 23
• Exact Mass: 490.38042938
• Heavy Atom Count: 33
• Complexity: 546

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CCCS(=O)(=O)[O-]

Technology Process of Dimethyl(3-stearamidepropyl)(3-sulphonatopropyl)ammonium

There total 1 articles about Dimethyl(3-stearamidepropyl)(3-sulphonatopropyl)ammonium 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: 91.0%

1,3-propanesultone (1120-71-4) + stearamidopropyl dimethylamine (7651-02-7) → C18AMP3SB (20284-67-7)

Guidance literature:

In ethyl acetate; at 80 ℃; for 8h;

DOI:10.1055/s-0029-1217973

upstream raw materials:

1,3-propanesultone

stearamidopropyl dimethylamine

Refernces

• 1、 Chu, Zonglin,Feng, Yujun. "A facile route towards the preparation of ultra-long-Chain amidosulfobetaine surfactants". experimental part. p. 2655 - 2658. Retrieved 2010/01/07.