2-(Dimethylamino)-2-methylpropanoic acid

Base Information

• Chemical Name: 2-(Dimethylamino)-2-methylpropanoic acid
• CAS No.: 6458-06-6
• Molecular Formula: C6H13NO2
• Molecular Weight: 131.175
• Hs Code.: 2922499990
• DSSTox Substance ID: DTXSID10214833
• Mol file: 6458-06-6.mol

Synonyms:2-(dimethylamino)-2-methylpropanoic acid;220022-94-6;N,N,2-trimethylalanine;2-Dimethylamino-2-methyl-propionic acid;SCHEMBL453425;DTXSID10214833;NTWMEKOIKAVWGG-UHFFFAOYSA-N;BBL013944;MFCD05230762;STK500930;2-(3-FLUORO-PHENYL)-AZEPANE;2-[n,n-dimethylamino]-isobutyric acid;AKOS005171480;AT29773;2-(dimethylamino)-2-methylpropanoicacid;VS-04058;BB 0248858;FT-0679132;FT-0737479;J-506386

Chemical Property of 2-(Dimethylamino)-2-methylpropanoic acid

Chemical Property:

• Melting Point: 120.5-121.0 °C(Solv: ethanol (64-17-5))
• PSA: 40.13000
• LogP: -1.16740
• XLogP3: -1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 131.094628657
• Heavy Atom Count: 9
• Complexity: 118

Purity/Quality:

99%,98%, ^*data from raw suppliers

2-CARBOXY-N,N,N-TRIMETHYLETHANAMINIUM INNER SALT 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C(=O)O)N(C)C

Technology Process of 2-(Dimethylamino)-2-methylpropanoic acid

There total 12 articles about 2-(Dimethylamino)-2-methylpropanoic acid 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: 88.0%

3-Bromopropionic acid (590-92-1) + trimethylamine (75-50-3) → betaine (6458-06-6)

Guidance literature:

In water; Ambient temperature;

DOI:10.1039/DT9910003253

Reference yield: 82.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 3-amino propanoic acid (107-95-9) → betaine (6458-06-6)

Guidance literature:

With formic acid; Heating;

DOI:10.1016/S0040-4039(00)79393-2

Reference yield:

S-adenosyl-L-[methyl-3H]Met + 3-dimethylaminopropionic acid (6300-04-5) + S-(5′-adenosyl)-L-methionine chloride → C6H10(3)H3NO2 + betaine (6458-06-6)

Guidance literature:

S-adenosyl-L-[methyl-³H]Met; 3-dimethylaminopropionic acid; S-(5′-adenosyl)-L-methionine chloride; With hydrogenchloride; tris-(hydroxymethyl)-aminomethane; D,L-dithiothreitol; N-methyltransferase; In water; at 30 ℃; for 0.5h; pH=8.0;

With trichloroacetic acid; In water; Kinetics;

upstream raw materials:

β-Propiolactone

acetonitrile

trimethylamine

acetylcholine

Downstream raw materials:

acrylic acid

trimethylamine