1-[(2S)-1-Benzoylpyrrolidin-2-yl]-2-bromoethan-1-one

Base Information

Chemical Name:1-[(2S)-1-Benzoylpyrrolidin-2-yl]-2-bromoethan-1-one
CAS No.:557790-55-3
Molecular Formula:C13H14BrNO2
Molecular Weight:296.164
Hs Code.:
DSSTox Substance ID:DTXSID50514122
Wikidata:Q82374277

Synonyms:1-[(2S)-1-Benzoylpyrrolidin-2-yl]-2-bromoethan-1-one;557790-55-3;SCHEMBL14144747;DTXSID50514122

Suppliers and Price of 1-[(2S)-1-Benzoylpyrrolidin-2-yl]-2-bromoethan-1-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 0 raw suppliers

Chemical Property of 1-[(2S)-1-Benzoylpyrrolidin-2-yl]-2-bromoethan-1-one

Chemical Property:

XLogP3:2.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:295.02079
Heavy Atom Count:17
Complexity:300

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC(N(C1)C(=O)C2=CC=CC=C2)C(=O)CBr
Isomeric SMILES:C1C[C@H](N(C1)C(=O)C2=CC=CC=C2)C(=O)CBr

Technology Process of 1-[(2S)-1-Benzoylpyrrolidin-2-yl]-2-bromoethan-1-one

There total 6 articles about 1-[(2S)-1-Benzoylpyrrolidin-2-yl]-2-bromoethan-1-one 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: 74.0%

: 137870-42-9
(S)-1-(1-benzoylpyrrolidin-2-yl)-2-diazoethanone

: 557790-55-3
1-benzoyl-2-bromoacetylpyrrolidine

Guidance literature:: With hydrogen bromide; In dichloromethane; at 0 - 20 ℃;
DOI:10.1023/A:1022131201542

Reference yield:

: 5874-58-8
N-(benzoyl)-L-proline

: 557790-55-3
1-benzoyl-2-bromoacetylpyrrolidine

Guidance literature:: Multi-step reaction with 3 steps

1: (COCl)2; DMF / CH₂Cl₂ / 20 h / 0 °C

2: 1.37 g / CH₂Cl₂; diethyl ether / 0.5 h / -5 °C

3: 74 percent / aqueous HBr / CH₂Cl₂ / 0 - 20 °C

With oxalyl dichloride; hydrogen bromide; N,N-dimethyl-formamide; In diethyl ether; dichloromethane;
DOI:10.1023/A:1022131201542

Reference yield:

: 98-88-4
benzoyl chloride

: 557790-55-3
1-benzoyl-2-bromoacetylpyrrolidine

Guidance literature:: Multi-step reaction with 4 steps

1: 75 percent / NaOH / 20 °C

2: (COCl)2; DMF / CH₂Cl₂ / 20 h / 0 °C

3: 1.37 g / CH₂Cl₂; diethyl ether / 0.5 h / -5 °C

4: 74 percent / aqueous HBr / CH₂Cl₂ / 0 - 20 °C

With sodium hydroxide; oxalyl dichloride; hydrogen bromide; N,N-dimethyl-formamide; In diethyl ether; dichloromethane;
DOI:10.1023/A:1022131201542