4-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine

Base Information

Chemical Name:4-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine
CAS No.:62649-32-5
Molecular Formula:C10H7ClF3N3
Molecular Weight:261.634
Hs Code.:
DSSTox Substance ID:DTXSID90586242
Wikidata:Q82478334

Synonyms:4-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine;63156-76-3;4-(4-Chlorophenyl)-5-(trifluoromethyl)-1H-pyrazol-3-amine;62649-32-5;1H-Pyrazol-5-amine, 4-(4-chlorophenyl)-3-(trifluoromethyl)-;SCHEMBL1279682;DTXSID90586242;BBL037244;MFCD09033909;STK392504;AKOS000269269;MCULE-5252824810;AS-36093;DB-152657;CS-0080462;EN300-41370;A914864;F2164-0004;Z385383570

Suppliers and Price of 4-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine

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

AK Scientific
4-(4-Chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine
5g
$ 1095.00

AK Scientific
4-(4-Chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine
1g
$ 415.00

Total 3 raw suppliers

Chemical Property of 4-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine

Chemical Property:

PSA：54.70000
LogP:3.91230
XLogP3:3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:1
Exact Mass:261.0280594
Heavy Atom Count:17
Complexity:266

Purity/Quality:

99% ^*data from raw suppliers

4-(4-Chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C2=C(NN=C2N)C(F)(F)F)Cl

Technology Process of 4-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine

There total 4 articles about 4-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine 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: 45.0%

: 383-63-1
ethyl trifluoroacetate,

: 140-53-4
p-chlorobenzyl cyanide

: 62649-32-5
4-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine

Guidance literature:: ethyl trifluoroacetate,; p-chlorobenzyl cyanide; With ethanol; sodium; at 50 ℃; for 2h; Reflux;

With hydrazinium sulfate; In carbonic acid dimethyl ester; at 80 ℃; for 4h; Molecular sieve;
DOI:10.1016/j.ejmech.2011.01.010

Reference yield:

: 1583-37-5
2-(4-chlorophenyl)-4,4,4-trifluoro-3-oxo-butyronitrile

: 62649-32-5
4-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine

Guidance literature:: With Methyl methanesulfonate; hydrazine hydrate; In ethanol; for 0.5h; Reflux;

Reference yield:

: 140-53-4
p-chlorobenzyl cyanide

: 62649-32-5
4-(4-chlorophenyl)-3-(trifluoromethyl)-1H-pyrazol-5-amine

Guidance literature:: Multi-step reaction with 2 steps

1.1: sodium ethanolate / ethanol / 2 h / Reflux

1.2: pH 5 - 6

2.1: Methyl methanesulfonate; hydrazine hydrate / ethanol / 0.5 h / Reflux

With Methyl methanesulfonate; hydrazine hydrate; sodium ethanolate; In ethanol;