N-(2-chloro-4-fluorophenyl)-2-cyanoacetamide

Base Information

Chemical Name:N-(2-chloro-4-fluorophenyl)-2-cyanoacetamide
CAS No.:87165-23-9
Molecular Formula:C9H6ClFN2O
Molecular Weight:212.611
Hs Code.:
DSSTox Substance ID:DTXSID10394604
Wikidata:Q82194090
Mol file:87165-23-9.mol

Synonyms:N-(2-chloro-4-fluorophenyl)-2-cyanoacetamide;87165-23-9;SCHEMBL1259154;DTXSID10394604;ADNIXAHGIPJFNZ-UHFFFAOYSA-N;AKOS008967223;2'-chloro-2-cyano-4'-fluoroacetanilide;BB 0218842;Z56837086

Suppliers and Price of N-(2-chloro-4-fluorophenyl)-2-cyanoacetamide

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

Crysdot
N-(2-Chloro-4-fluorophenyl)-2-cyanoacetamide 97%
10g
$ 484.00

American Custom Chemicals Corporation
N-(2-CHLORO-4-FLUOROPHENYL)-2-CYANOACETAMIDE 95.00%
5MG
$ 499.14

Total 2 raw suppliers

Chemical Property of N-(2-chloro-4-fluorophenyl)-2-cyanoacetamide

Chemical Property:

PSA：56.38000
LogP:2.98078
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:212.0152687
Heavy Atom Count:14
Complexity:263

Purity/Quality:: N-(2-Chloro-4-fluorophenyl)-2-cyanoacetamide 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=C(C=C1F)Cl)NC(=O)CC#N

Technology Process of N-(2-chloro-4-fluorophenyl)-2-cyanoacetamide

There total 1 articles about N-(2-chloro-4-fluorophenyl)-2-cyanoacetamide 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: 54.0%

: 2106-02-7
2-chloro-4-fluoroaniline

: 372-09-8
cyanoacetic acid

: 87165-23-9
N-(2-chloro-4-fluorophenyl)-2-cyanoacetamide

Guidance literature:: With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; triethylamine; In N,N-dimethyl-formamide; at 20 ℃; for 16h;

Reference yield: 30.0%

: 87165-23-9
N-(2-chloro-4-fluorophenyl)-2-cyanoacetamide

: 51731-17-0
trans-4-methoxy-3-buten-2-one

: 1195781-65-7
1-(2-chloro-4-fluorophenyl)-6-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile

Guidance literature:: With 1,4-diaza-bicyclo[2.2.2]octane; In 2-(2-methoxyethoxy)ethyl alcohol; at 130 ℃; for 3h;

Reference yield:

: 87165-23-9
N-(2-chloro-4-fluorophenyl)-2-cyanoacetamide

: 1195781-66-8
1-(2-chloro-4-fluorophenyl)-6-methyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: 1,4-diaza-bicyclo[2.2.2]octane / 2-(2-methoxyethoxy)ethyl alcohol / 3 h / 130 °C

2: sulfuric acid; water / 0 - 100 °C

With 1,4-diaza-bicyclo[2.2.2]octane; sulfuric acid; water; In 2-(2-methoxyethoxy)ethyl alcohol;