(3-Chloro-2-hydroxypropyl)dimethyloctadecylammonium chloride

Base Information

• Chemical Name: (3-Chloro-2-hydroxypropyl)dimethyloctadecylammonium chloride
• CAS No.: 3001-63-6
• Deprecated CAS: 2376345-80-9
• Molecular Formula: C23H49 Cl N O . Cl
• Molecular Weight: 426.554
• European Community (EC) Number: 221-083-1
• UNII: JT8J7696TO
• DSSTox Substance ID: DTXSID90952423
• Mol file: 3001-63-6.mol

Synonyms:3001-63-6;(3-Chloro-2-hydroxypropyl)dimethyloctadecylammonium chloride;EINECS 221-083-1;JT8J7696TO;Ammonium, (2-hydroxy-3-chloropropyl)octadecyldimethyl-, chloride;N,N-Dimethyl-n-octadecyl(2-hydroxy-3-chloropropyl) ammonium chloride;3-Chloro-2-hydroxypropylstearyldimethylammonium chloride;1-Octadecanaminium, N-(3-chloro-2-hydroxypropyl)-N,N-dimethyl-, chloride (1:1);C23H49ClNO.Cl;n-(3-chloro-2-hydroxypropyl)-n,n-dimethyloctadecan-1-aminium chloride;UNII-JT8J7696TO;SCHEMBL99575;QUAB-426;C23-H49-Cl-N-O.Cl;DTXSID90952423;AKOS005145547;LS-18206;W-109845;(3-Chloro-2-OHpropyl)dimethyloctadecylammonium chloride;3-chloro-2-hydroxypropyldimethyloctadecylammonium chloride;(3-chloro-2-hydroxypropyl)-dimethyl-octadecylazanium;chloride;Ammonium, (3-chloro-2-hydroxypropyl)dimethyloctadecyl-, chloride;OCTADECYLDIMETHYL(2-HYDROXY-3-CHLOROPROPYL)AMMONIUM CHLORIDE;(3-CHLORO-2-HYDROXYPROPYL)-N,N,N-DIMETHYLOCTADECYLAMMONIUM CHLORIDE;1-Octadecanaminium, N-(3-chloro-2-hydroxypropyl)-N,N-dimethyl-, chloride

Chemical Property of (3-Chloro-2-hydroxypropyl)dimethyloctadecylammonium chloride

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 20.23000
• Density: g/cm³
• LogP: 3.92800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 20
• Exact Mass: 425.3191206
• Heavy Atom Count: 27
• Complexity: 283

Purity/Quality:

99.0% ^*data from raw suppliers

QUAB 426 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCC[N+](C)(C)CC(CCl)O.[Cl-]

Technology Process of (3-Chloro-2-hydroxypropyl)dimethyloctadecylammonium chloride

There total 3 articles about (3-Chloro-2-hydroxypropyl)dimethyloctadecylammonium chloride 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:

N,N-dimethyl-n-octadecylamine (124-28-7) + epichlorohydrin (106-89-8,24969-06-0,13403-37-7) → N-(3-chloro-2-hydroxypropyl)-N,N-dimethyloctadecyl ammonium chloride (3001-63-6)

Guidance literature:

With hydrogenchloride; In diethyl ether; water; at 80 ℃; for 12.58h;

Reference yield:

stearyl dimethyl ammonium chloride + epichlorohydrin (106-89-8,24969-06-0,13403-37-7) → N-(3-chloro-2-hydroxypropyl)-N,N-dimethyloctadecyl ammonium chloride (3001-63-6)

Guidance literature:

stearyl dimethyl ammonium chloride; With hydrogenchloride; at 25 ℃; for 2h;

epichlorohydrin; at 30 - 50 ℃; for 6.75h;

Reference yield:

→ N-(3-chloro-2-hydroxypropyl)-N,N-dimethyloctadecyl ammonium chloride (3001-63-6)

Guidance literature:

upstream raw materials:

epichlorohydrin

N,N-dimethyl-n-octadecylamine

Refernces

• 1、 -. "Double electron type polymerizable surfactant monomer, and preparation method and applications thereof". Paragraph 0031; 0032. . Retrieved 2019/07/04.
• 2、 -. "Acrylic acid biquaternary ammonium salt grafted non-woven fabric wet tissue and preparation method thereof". Paragraph 0044; 0045; 0046. . Retrieved 2018/03/25.