Methyl 2-amino-2-methylpropanoate hydrochloride

Base Information

• Chemical Name: Methyl 2-amino-2-methylpropanoate hydrochloride
• CAS No.: 15028-41-8
• Molecular Formula: C5H11NO2^.HCl
• Molecular Weight: 153.609
• Hs Code.: 29224999
• European Community (EC) Number: 864-887-3
• DSSTox Substance ID: DTXSID20532515
• Mol file: 15028-41-8.mol

Synonyms:11C-MeAIB;14C-MeAIB;2,2-dimethyl-beta-alanine;2-methylaminoisobutyric acid;3-amino-2,2-dimethyl-propanoic acid;alpha-(N-methyl-11C)-methylaminoisobutyric acid;alpha-(N-methyl-14C)-methylaminoisobutyric acid;Me-AIB;MeAIB;methyl 2-aminoisobutyrate hydrochloride;propanoic acid, 3-amino-2,2-dimethyl-

Chemical Property of Methyl 2-amino-2-methylpropanoate hydrochloride

Chemical Property:

• Vapor Pressure: 15.1mmHg at 25°C
• Melting Point: 185°C
• Boiling Point: 120.6 °C at 760 mmHg
• Flash Point: 56.1 °C
• PSA: 52.32000
• LogP: 1.39900
• Storage Temp.: −20°C
• Water Solubility.: Slightly soluble in water.
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 153.0556563
• Heavy Atom Count: 9
• Complexity: 98.6

Purity/Quality:

99.9% ^*data from raw suppliers

2-AminoisobutanoicAcidMethylEsterHydrochloride ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C(=O)OC)N.Cl
• Uses: Methyl α-aminoisobutyrate is used as a specific substrate of amino acid transport system and in studies on amino acid transport systems.

Technology Process of Methyl 2-amino-2-methylpropanoate hydrochloride

There total 9 articles about Methyl 2-amino-2-methylpropanoate hydrochloride 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: 100.0%

methanol (67-56-1) + 2-Aminoisobutyric acid (62-57-7) → methyl 2-aminoisobutyrate hydrochloride (15028-41-8)

Guidance literature:

With thionyl chloride; at 0 - 20 ℃; Inert atmosphere; Reflux;

DOI:10.1021/ol302096j

Reference yield: 100.0%

2-Aminoisobutyric acid (62-57-7) → methyl 2-aminoisobutyrate hydrochloride (15028-41-8)

Guidance literature:

With thionyl chloride; In methanol;

DOI:10.1039/c2cc30926b

Reference yield: 89.2%

→ methyl 2-aminoisobutyrate hydrochloride (15028-41-8)

Guidance literature:

upstream raw materials:

methanol

2-Aminoisobutyric acid

chloro-trimethyl-silane

2-amino-2-methylpropanoyl chloride

Downstream raw materials:

2-methoxy-2-methylpropanoic acid

methacrylic acid methyl ester

methyl 2-((diphenylmethylene)amino)-2-methylpropanoate

N-(tert-butoxycarbonyl)-L-tyrosyl-α-aminoisobutyric acid methyl ester

Refernces

• 1、 Sedlak, Milos,Halama, Ales,Kavalek, Jaromir,Machacek, Vladimir,Mitas, Petr,Sterba, Vojeslav. "Preparation and NMR spectra of substituted 2-(4-nitrophenyl)imidazolinones". . p. 910 - 920. Retrieved 1996.
• 2、 Mir, Fatemeh M.,Crisma, Marco,Toniolo, Claudio,Lubell, William D.. "Influence of the C-terminal substituent on the crystal-state conformation of Adm peptides". . . Retrieved 2020.
• 3、 Nagren, Kjell,Sutinen, Eija,Jyrkkio, Sirkku. "[N-methyl-11C]MeAIB, a Tracer for System A Amino Acid Transport: Preparation from [11C]Methyl Triflate and HPLC Metabolite Analysis of Plasma Samples After Intravenous Administration in Man". . p. 1013 - 1021. Retrieved 2000.
• 4、 Yan, Qiao,Carroll, Patrick J.,Gau, Michael R.,Winkler, Jeffrey D.,Joullié, Madeleine M.. "A Transannular Rearrangement Reaction of a Pyrroloindoline Diketopiperazine". . p. 6619 - 6623. Retrieved 2019.
• 5、 Kervefors, Gabriella,Kersting, Leonard,Olofsson, Berit. "Transition Metal-Free N-Arylation of Amino Acid Esters with Diaryliodonium Salts". supporting information. p. 5790 - 5795. Retrieved 2021/03/08.