2,5-Dioxopyrrolidin-1-YL 2-phenylacetate

Base Information

• Chemical Name: 2,5-Dioxopyrrolidin-1-YL 2-phenylacetate
• CAS No.: 23776-85-4
• Molecular Formula: C12H11NO4
• Molecular Weight: 233.224
• Hs Code.: 2925190090
• European Community (EC) Number: 857-895-3
• DSSTox Substance ID: DTXSID80537405
• Nikkaji Number: J428.392I
• Wikidata: Q82412389
• Mol file: 23776-85-4.mol

Synonyms:23776-85-4;2,5-DIOXOPYRROLIDIN-1-YL 2-PHENYLACETATE;(2,5-dioxopyrrolidin-1-yl) 2-phenylacetate;PHENYL-ACETIC ACID 2,5-DIOXO-PYRROLIDIN-1-YL ESTER;SCHEMBL2450503;DTXSID80537405;AKOS026677310;1-[(Phenylacetyl)oxy]pyrrolidine-2,5-dione;CS-0235947;(2, 5-dioxopyrrolidin-1-yl) 2-phenylacetate;EN300-1657487;F1905-6994

Chemical Property of 2,5-Dioxopyrrolidin-1-YL 2-phenylacetate

Chemical Property:

• PSA: 63.68000
• LogP: 0.77420
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 233.06880783
• Heavy Atom Count: 17
• Complexity: 317

Purity/Quality:

99% ^*data from raw suppliers

PHENYL-ACETIC ACID 2,5-DIOXO-PYRROLIDIN-1-YL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC(=O)N(C1=O)OC(=O)CC2=CC=CC=C2

Technology Process of 2,5-Dioxopyrrolidin-1-YL 2-phenylacetate

There total 4 articles about 2,5-Dioxopyrrolidin-1-YL 2-phenylacetate 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: 97.0%

phenylacetic acid (103-82-2) + 1-hydroxy-pyrrolidine-2,5-dione (6066-82-6) → N-(phenylacetyl)oxysuccinimide (23776-85-4)

Guidance literature:

With dicyclohexyl-carbodiimide; In ethyl acetate;

DOI:10.1021/jm00157a005

Reference yield: 70.0%

1-hydroxy-pyrrolidine-2,5-dione (6066-82-6) + phenylacetyl chloride (103-80-0) → N-(phenylacetyl)oxysuccinimide (23776-85-4)

Guidance literature:

With 4-methyl-morpholine; In dichloromethane; for 3h; Ambient temperature;

DOI:10.1248/cpb.38.110

Reference yield:

1-hydroxy-pyrrolidine-2,5-dione (6066-82-6) + phenylacetaldehyde (122-78-1) → N-(phenylacetyl)oxysuccinimide (23776-85-4)

Guidance literature:

With [bis(acetoxy)iodo]benzene; In acetonitrile; at 0 ℃; for 1h; Inert atmosphere;

DOI:10.1002/adsc.201400188

upstream raw materials:

phenylacetic acid

1-hydroxy-pyrrolidine-2,5-dione

phenylacetyl chloride

phenylacetaldehyde

Downstream raw materials:

1-(N-Phenylacetylamino)-3-methylbutylphosphonic acid

(2S,3aS,7aS)-1-(N²-phenylacetyl-L-lysyl-γ-D-glutamyl)octahydro-1H-indole-2-carboxylic acid

Z-Phe-gGly-COBzl

2,2,5,5-Tetramethyl-2,5-dihydro-1H-pyrrole-3-carboxylic acid (3-phenylacetylamino-propyl)-amide