Dimethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)(3-sulphopropyl)ammonium hydroxide

Base Information

• Chemical Name: Dimethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)(3-sulphopropyl)ammonium hydroxide
• CAS No.: 3637-26-1
• Molecular Formula: C11H21NO5S
• Molecular Weight: 279.357
• Hs Code.: 29239000
• European Community (EC) Number: 222-860-8
• DSSTox Substance ID: DTXSID10189895
• Wikidata: Q72470892
• Mol file: 3637-26-1.mol

Synonyms:3637-26-1;3-[dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azaniumyl]propane-1-sulfonate;3-((2-(Methacryloyloxy)ethyl)dimethylammonio)propane-1-sulfonate;Dimethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)(3-sulphopropyl)ammonium hydroxide;C11H21NO5S;EINECS 222-860-8;[2-(Methacryloyloxy)ethyl]dimethyl-(3-sulfopropyl)ammonium hydroxide;N-(3-Sulfopropyl)-N-methacryloxyethyl-N,N-dimethylammonium betaine;1-Propanaminium,N,N-dimethyl-N-[2-[(2-methyl-1-oxo-2-propenyl)oxy]ethyl]-3-sulfo-, innersalt;3-[[2-(Methacryloyloxy)ethyl]dimethylammonio]propane-1-sulfonate;Dimethyl[2-[(2-methyl-1-oxoallyl)oxy]ethyl](3-sulphopropyl)ammonium hydroxide;SCHEMBL866754;DTXSID10189895;BCAIDFOKQCVACE-UHFFFAOYSA-N;C11-H21-N-O5-S;MFCD00040574;AKOS015916728;FS-4685;CS-0158070;FT-0758583;M1971;D82256;A823217;[2-(Methacryloyloxy)ethyl]dimethyl-(3-sulfopropyl);3-[N-(2-methacryloxylethyl)-N,N-dimethylammonio]-propane sulfonate;N-(3-Sulfopropyl)-N-methacroyloxyethyl-N,N-dimethylammoniumbetaine;N-(3-SULFOPROPYL)-N-METHACRYLOXYETHYL-N,N-DIMETHYLAMMONIUM BETAINE (SPE)

Chemical Property of Dimethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)(3-sulphopropyl)ammonium hydroxide

Chemical Property:

• Appearance/Colour: White Powder, Crystals or Crystalline Powder
• Melting Point: 150-155 °C(lit.)
• Flash Point: >110°C
• PSA: 91.88000
• Density: 1.293-1.303g/cm3 at 22℃
• LogP: 1.19820
• Storage Temp.: Store below +30°C.
• Solubility.: 500g/l
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 279.11404394
• Heavy Atom Count: 18
• Complexity: 381

Purity/Quality:

99.9% ^*data from raw suppliers

N-[2-(Methacryloyloxy)ethyl]-N,N-dimethyl-N-(3-sulfopropyl)betaine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 21/22
• Safety Statements: 37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(=C)C(=O)OCC[N+](C)(C)CCCS(=O)(=O)[O-]
• Uses: Due to its hygroscopic nature, [2-(methacryloyloxy)ethyl]dimethyl-(3-sulfopropyl)ammonium hydroxide (DMAPS) can contain up to one molecule of water per monomer unit. This material should be stored in a cool, dry place and depending on the reaction conditions, water may need to be removed prior to polymerization.

Technology Process of Dimethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)(3-sulphopropyl)ammonium hydroxide

There total 3 articles about Dimethyl(2-((2-methyl-1-oxoallyl)oxy)ethyl)(3-sulphopropyl)ammonium hydroxide 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: 98.0%

1,3-propanesultone (1120-71-4) + 2-(dimethylamino)ethyl methacrylate (2867-47-2) → 3-[N,N-dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]ammonium]propane-1-sulfonic acid (3637-26-1)

Guidance literature:

In acetonitrile; at 4 - 25 ℃; for 72h;

DOI:10.1039/c4ra15003a

Reference yield: 62.0%

poly(methacrylic acid) (79-41-4,25087-26-7,50867-57-7) + 3-[(2-hydroxyethyl)dimethylammonio]propane-1-sulfonate (38880-58-9) → 3-[N,N-dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]ammonium]propane-1-sulfonic acid (3637-26-1)

Guidance literature:

poly(methacrylic acid); 3-[(2-hydroxyethyl)dimethylammonio]propane-1-sulfonate; With hydroquinone; at 70 ℃; for 0.5h; Inert atmosphere;

With sulfuric acid; at 70 ℃; for 48h; Inert atmosphere;

DOI:10.1002/ejoc.201402734

Reference yield:

→ 3-[N,N-dimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]ammonium]propane-1-sulfonic acid (3637-26-1)

Guidance literature:

Tert. Amin, S-Verb.;

upstream raw materials:

poly(methacrylic acid)

3-[(2-hydroxyethyl)dimethylammonio]propane-1-sulfonate

1,3-propanesultone

2-(dimethylamino)ethyl methacrylate

Refernces

• 1、 -. "Synthesis method of SPE". Paragraph 0007; 0023-0030. . Retrieved 2019/01/17.
• 2、 -. "REACTIVE IONIC LIQUID, ION-FIXING METAL OXIDE PARTICLES USING SAME, ION-FIXING ELASTOMER, AND TRANSDUCER". Paragraph 0094. . Retrieved 2015/03/03.