1-Methyl-2-oxopyrrolidine-3-carboxylic acid

Base Information

• Chemical Name: 1-Methyl-2-oxopyrrolidine-3-carboxylic acid
• CAS No.: 30932-84-4
• Molecular Formula: C6H9NO3
• Molecular Weight: 143.142
• Hs Code.: 2933790090
• European Community (EC) Number: 815-496-1
• DSSTox Substance ID: DTXSID20564932
• Mol file: 30932-84-4.mol

Synonyms:1-methyl-2-oxopyrrolidine-3-carboxylic acid;30932-84-4;1-methyl-2-oxo-3-pyrrolidinecarboxylic acid;3-Pyrrolidinecarboxylic acid, 1-methyl-2-oxo-;MFCD19228580;SCHEMBL783029;DTXSID20564932;LRQXSOWYUQJAOH-UHFFFAOYSA-N;AKOS006380529;SB13905;AS-66535;SY069187;1-methyl-2-oxopyrrolidine-3-carboxylicacid;CS-0096284;EN300-141695;Z1205494535

Chemical Property of 1-Methyl-2-oxopyrrolidine-3-carboxylic acid

Chemical Property:

• Boiling Point: 361.7±35.0 °C(Predicted)
• PKA: 4.19±0.20(Predicted)
• PSA: 57.61000
• Density: 1.319±0.06 g/cm3(Predicted)
• LogP: -0.51280
• Storage Temp.: 2-8°C
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 143.058243149
• Heavy Atom Count: 10
• Complexity: 178

Purity/Quality:

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

1-methyl-2-oxopyrrolidine-3-carboxylicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCC(C1=O)C(=O)O

Technology Process of 1-Methyl-2-oxopyrrolidine-3-carboxylic acid

There total 5 articles about 1-Methyl-2-oxopyrrolidine-3-carboxylic 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: 91.0%

1-methyl-2-oxo-pyrrolidine-3-carboxylic acid ethyl ester (30932-85-5) → 1-methyl-2-oxo-pyrrolidine-3-carboxylic acid (30932-84-4)

Guidance literature:

With sodium hydroxide; In methanol; water; at 20 ℃; Inert atmosphere;

DOI:10.1021/acs.orglett.5b03080

Reference yield: 74.2%

(+/-)-1-methyl-2-oxo-pyrrolidine-3-carboxylic acid methyl ester (114724-98-0) → 1-methyl-2-oxo-pyrrolidine-3-carboxylic acid (30932-84-4)

Guidance literature:

(+/-)-1-methyl-2-oxo-pyrrolidine-3-carboxylic acid methyl ester; With potassium trimethylsilonate; In tetrahydrofuran; at 20 ℃;

With hydrogenchloride; In tetrahydrofuran; diethyl ether; for 0.0833333h;

Reference yield:

benzyl-1-methyl-2-oxopyrrolidine-3-carboxylate (1370017-97-2) → 1-methyl-2-oxo-pyrrolidine-3-carboxylic acid (30932-84-4)

Guidance literature:

With 5%-palladium/activated carbon; hydrogen; In ethyl acetate; for 2h;

DOI:10.1016/j.tetlet.2012.01.120

upstream raw materials:

(+/-)-1-methyl-2-oxo-pyrrolidine-3-carboxylic acid methyl ester

1-methyl-pyrrolidin-2-one

benzyl-1-methyl-2-oxopyrrolidine-3-carboxylate

1-methyl-2-oxo-pyrrolidine-3-carboxylic acid ethyl ester

Downstream raw materials:

N-(3-fluoro-4-(3-iodo-1-(4-methoxybenzyl)-1H-pyrazolo[3,4-b]pyridin-4-yloxy)phenyl)-1-methyl-2-oxopyrrolidine-3-carboxamide

N-(4-(1-(4-methoxybenzyl)-3-methyl-1H-pyrazolo[3,4-b]pyridin-4-yloxy)-3-fluorophenyl)-1-methyl-2-oxopyrrolidine-3-carboxamide

N-(3-fluoro-4-(2-iodothieno[3,2-b]pyridin-7-yloxy)phenyl)-1-methyl-2-oxopyrrolidine-3-carboxamide

N-benzyl-1-methyl-2-oxo-N-phenylpyrrolidine-3-carboxamide