1-Tetradecanaminium, N-(carboxymethyl)-N,N-dimethyl-, inner salt

Base Information

• Chemical Name: 1-Tetradecanaminium, N-(carboxymethyl)-N,N-dimethyl-, inner salt
• CAS No.: 2601-33-4
• Deprecated CAS: 41117-57-1
• Molecular Formula: C18H37 N O2
• Molecular Weight: 299.497
• European Community (EC) Number: 220-006-9
• UNII: 95C19D1X0B
• DSSTox Substance ID: DTXSID4041288
• Wikidata: Q27271781
• Mol file: 2601-33-4.mol

Synonyms:Myristyl betaine;2601-33-4;1-Tetradecanaminium, N-(carboxymethyl)-N,N-dimethyl-, inner salt;2-[dimethyl(tetradecyl)azaniumyl]acetate;Myristyl dimethyl betaine;Myristyl dimethyl glycine;(N,N-Dimethylmyristylammonio)acetate;N-TETRADECYL-N,N-DIMETHYLGLYCINE;UNII-95C19D1X0B;(Carboxylatomethyl)dimethyltetradecylammonium;95C19D1X0B;EINECS 220-006-9;1-Tetradecanaminium, N-(carboxymethyl)-N,N-dimethyl-, hydroxide, inner salt;Ammonium, (carboxymethyl)dimethyltetradecyl-, hydroxide, inner salt;N-(Carboxymethyl)-N,N-dimethyl-1-tetradecanaminium hydroxide, inner salt;N-TETRADECYL BETAINE;SCHEMBL353921;MYRISTYL BETAINE [INCI];DTXSID4041288;2-(dimethyl(tetradecyl)ammonio)acetate;HY-W250190;CS-0310490;Q27271781;(N,N-Dimethylmyristylammonio)acetate, >=97.0% (HPLC)

Chemical Property of 1-Tetradecanaminium, N-(carboxymethyl)-N,N-dimethyl-, inner salt

Chemical Property:

• Vapor Pressure: 0Pa at 25℃
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 40.13000
• Density: g/cm³
• LogP: 3.51380
• Solubility.: H2O: soluble1%, clear, colorless
• XLogP3: 7.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 14
• Exact Mass: 299.282429423
• Heavy Atom Count: 21
• Complexity: 246

Purity/Quality:

99.9% ^*data from raw suppliers

(N,N-Dimethylmyristylammonio)acetate ≥97.0% (HPLC) ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCC[N+](C)(C)CC(=O)[O-]

Technology Process of 1-Tetradecanaminium, N-(carboxymethyl)-N,N-dimethyl-, inner salt

There total 4 articles about 1-Tetradecanaminium, N-(carboxymethyl)-N,N-dimethyl-, inner salt 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-tetradecylamine (112-75-4) + sodium monochloroacetic acid (3926-62-3) → N,N-Dimethyl-N-tetradecylglycine (2601-33-4)

Guidance literature:

In ethanol; Heating;

Reference yield:

1-Bromotetradecane (112-71-0) → N,N-Dimethyl-N-tetradecylglycine (2601-33-4)

Guidance literature:

Multi-step reaction with 2 steps

2: aq. ethanol / Heating

In ethanol;

Reference yield:

methyl N-tetradecyl-N,N-dimethylglycinate (113386-45-1) → N,N-Dimethyl-N-tetradecylglycine (2601-33-4)

Guidance literature:

With sodium hydroxide; cetyltrimethylammonium hydroxide; at 25 ℃; Rate constant; other cationic micelles or without NaOH;

DOI:10.1016/S0040-4020(01)89962-2

upstream raw materials:

N,N-dimethyl-n-tetradecylamine

sodium monochloroacetic acid

methyl N-tetradecyl-N,N-dimethylglycinate

1-Bromotetradecane

Refernces

• 1、 -. "AMINO- OR AMMONIUM-CONTAINING SULFONIC ACID, PHOSPHONIC ACID AND CARBOXYLIC ACID DERIVATIVES AND THEIR MEDICAL USE". Page/Page column 41. . Retrieved 2012/12/13.
• 2、 Cipiciani, Antonio,Primieri, Stefania. "The Effects of Zwitterionic Surfactant Systems upon Aromatic Nucleophilic Substitution". . p. 1365 - 1367. Retrieved 2007/10/02.