1-(2-Chloroacetyl)-5-oxopyrrolidine-2-carbonitrile

Base Information

Chemical Name:1-(2-Chloroacetyl)-5-oxopyrrolidine-2-carbonitrile
CAS No.:98062-39-6
Molecular Formula:C₇H₇ClN₂O₂
Molecular Weight:186.598
Hs Code.:
DSSTox Substance ID:DTXSID70541652
Mol file:98062-39-6.mol

Synonyms:98062-39-6;1-(2-Chloroacetyl)-5-oxopyrrolidine-2-carbonitrile;DTXSID70541652;1-(Chloroacetyl)-5-oxopyrrolidine-2-carbonitrile

Suppliers and Price of 1-(2-Chloroacetyl)-5-oxopyrrolidine-2-carbonitrile

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 2 raw suppliers

Chemical Property of 1-(2-Chloroacetyl)-5-oxopyrrolidine-2-carbonitrile

Chemical Property:

PSA：61.17000
LogP:0.20428
XLogP3:0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:186.0196052
Heavy Atom Count:12
Complexity:268

Purity/Quality:: 95% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CC(=O)N(C1C#N)C(=O)CCl

Technology Process of 1-(2-Chloroacetyl)-5-oxopyrrolidine-2-carbonitrile

There total 3 articles about 1-(2-Chloroacetyl)-5-oxopyrrolidine-2-carbonitrile 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: 80.0%

: 98062-38-5
N-trimethylsilyl-5-cyano-2-pyrrolidinone

: 79-04-9
chloroacetyl chloride

: 98062-39-6
N-chloroacetylpyroglutamic acid nitrile

Guidance literature:: In tetrahydrofuran; for 14h; Heating;
DOI:10.1002/jhet.5570230137

Reference yield:

: 98062-53-4
tris(trimethylsilyl)-2-pyrrolidinone-5-carboxamide

: 98062-39-6
N-chloroacetylpyroglutamic acid nitrile

Guidance literature:: Multi-step reaction with 2 steps

1: ZnCl₂ / 80 °C

2: 80 percent / tetrahydrofuran / 14 h / Heating

With zinc(II) chloride; In tetrahydrofuran;
DOI:10.1002/jhet.5570230137

Reference yield:

: 5626-52-8
5-oxo-pyrrolidine-2-carboxylic acid amide

: 98062-39-6
N-chloroacetylpyroglutamic acid nitrile

Guidance literature:: Multi-step reaction with 3 steps

1: ZnCl₂ / triethylamine / 14 h / Heating

2: ZnCl₂ / 80 °C

3: 80 percent / tetrahydrofuran / 14 h / Heating

With zinc(II) chloride; In tetrahydrofuran; triethylamine;
DOI:10.1002/jhet.5570230137