1-(4-Methoxybenzyl)-5-oxoproline

Base Information

• Chemical Name: 1-(4-Methoxybenzyl)-5-oxoproline
• CAS No.: 116404-25-2
• Molecular Formula: C13H15NO4
• Molecular Weight: 249.266
• Nikkaji Number: J1.826.210J
• Mol file: 116404-25-2.mol

Synonyms:SCHEMBL10377856;FWFUCUAZXZTVKU-UHFFFAOYSA-N;AKOS012171437;1-(4-METHOXYBENZYL)-5-OXOPROLINE;1-(4-Methoxybenzyl)-5-oxopyrrolidine-2-carboxylic acid;(+/-)-1-[(4-Methoxyphenyl)methyl]-5-oxo-2-pyrrolidinecarboxylic acid

Chemical Property of 1-(4-Methoxybenzyl)-5-oxoproline

Chemical Property:

• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 249.10010796
• Heavy Atom Count: 18
• Complexity: 323

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)CN2C(CCC2=O)C(=O)O

Technology Process of 1-(4-Methoxybenzyl)-5-oxoproline

There total 1 articles about 1-(4-Methoxybenzyl)-5-oxoproline 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:

methyl 1-(4-methoxybenzyl)-5-oxopyrrolidine-2-carboxylate → (+/-)-1-[(4-Methoxyphenyl)methyl]-5-oxo-2-pyrrolidinecarboxylic acid (116404-25-2)

Guidance literature:

With hydrogenchloride; sodium hydroxide; In water;

Reference yield: 60.0%

(+/-)-1-[(4-Methoxyphenyl)methyl]-5-oxo-2-pyrrolidinecarboxylic acid (116404-25-2) → 7-methoxy-1,2,3,5,10,10a-hexahydrobenz[f]indolizine-3,10-dione (116344-68-4) + 5-hydroxy-1-(4-methoxybenzyl)pyrrolidin-2-one (122123-86-8)

Guidance literature:

(+/-)-1-[(4-Methoxyphenyl)methyl]-5-oxo-2-pyrrolidinecarboxylic acid; With thionyl chloride; In 1,2-dichloro-ethane; for 0.5h; Heating;

With aluminium trichloride; In 1,2-dichloro-ethane; at 8 ℃; for 4h;

DOI:10.1016/S0040-4020(02)01183-3

Downstream raw materials:

7-methoxy-1,2,3,5,10,10a-hexahydrobenz[f]indolizine-3,10-dione

5-hydroxy-1-(4-methoxybenzyl)pyrrolidin-2-one