Methyl 3-(dimethylamino)-2-methylpropanoate

Base Information

• Chemical Name: Methyl 3-(dimethylamino)-2-methylpropanoate
• CAS No.: 10205-34-2
• Molecular Formula: C7H15 N O2
• Molecular Weight: 145.202
• Hs Code.: 2922499990
• European Community (EC) Number: 233-505-1
• DSSTox Substance ID: DTXSID60907021
• Nikkaji Number: J227.106K
• Mol file: 10205-34-2.mol

Synonyms:methyl 3-(dimethylamino)-2-methylpropanoate;10205-34-2;Methyl beta-(dimethylamino)isobutyrate;Methyl 3-dimethylamino-2-methylpropionate;Methyl 3-(dimethylamino)-2-methylpropionate;EINECS 233-505-1;Propanoic acid, 3-(dimethylamino)-2-methyl-, methyl ester;SCHEMBL7136164;DTXSID60907021;MFCD00044842;STK502929;Methyl .beta.-dimethylaminoisobutyrate;AKOS000321351;AKOS016342128;AS-70488;BB 0240836;CS-0318899;FT-0613765;C80074;methyl beta-(dimethylamino)isobutyrate, AldrichCPR;3-(Dimethylamino)-2-methylpropionic acid methyl ester;3-Dimethylamino-2-methyl-propionic acid methyl ester;Propanoic acid,3-(dimethylamino)-2-methyl-,methyl ester

Chemical Property of Methyl 3-(dimethylamino)-2-methylpropanoate

Chemical Property:

• Vapor Pressure: 1.8mmHg at 25°C
• Refractive Index: 1.416-1.42
• Boiling Point: 166.2°Cat760mmHg
• PKA: 8.85±0.28(Predicted)
• Flash Point: 55°C
• PSA: 29.54000
• Density: 0.935g/cm³
• LogP: 0.35710
• Storage Temp.: 2-8°C
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 145.110278721
• Heavy Atom Count: 10
• Complexity: 112

Purity/Quality:

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

Methyl3-(Dimethylamino)-2-methylpropanoate ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn
• Hazard Codes: Xn
• Statements: 36/37/38-52-36-22
• Safety Statements: 24/25-26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CN(C)C)C(=O)OC

Technology Process of Methyl 3-(dimethylamino)-2-methylpropanoate

There total 4 articles about Methyl 3-(dimethylamino)-2-methylpropanoate 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:

dimethyl amine (124-40-3) + methacrylic acid methyl ester (80-62-6,114512-63-9,143476-91-9,25188-98-1,9011-14-7) → methyl β-(dimethylamino)isobutyrate (10205-34-2)

Guidance literature:

In methanol;

DOI:10.1021/jo01062a010

Reference yield:

methyl 3-(dimethylamino)propionate (3853-06-3) + methyl iodide (74-88-4) → methyl β-(dimethylamino)isobutyrate (10205-34-2)

Guidance literature:

Multistep reaction; (i) LDA, (ii) /BRN= 969135/, HMPT;

DOI:10.1016/S0040-4039(00)70536-3

Reference yield:

ethanol (64-17-5) + methyl methacrylate (97-63-2,9003-42-3) + methylamine (74-89-5) → methyl β-(dimethylamino)isobutyrate (10205-34-2)

Guidance literature:

DOI:10.1021/jo01377a001

upstream raw materials:

ethanol

methyl methacrylate

methylamine

dimethyl amine

Downstream raw materials:

2-methyl-3-dimethylaminopropanol

3-Dimethylamino-2-methyl-propansaeure

2-Acetoxy-2-benzyl-4-dimethylamino-3-methyl-1-phenyl-butan

perfluoropropanoyl fluoride

Refernces

• 1、 Coutts,Hubbard,Midha,Prasad. "Synthesis and properties of some hypotensive N-alkylaminopropionic esters and N,N-dialkylaminopropionic esters and their hydroxamic acids.". . p. 28 - 33. Retrieved 2007/10/04.