5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile

Base Information

Chemical Name:5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile
CAS No.:58791-82-5
Molecular Formula:C11H9ClN4
Molecular Weight:232.672
Hs Code.:2933199090
DSSTox Substance ID:DTXSID80484945
Wikidata:Q82323739
Mol file:58791-82-5.mol

Synonyms:58791-82-5;5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile;5-Amino-4-cyano-1-(4-chlorophenyl)-3-methylpyrazole;5-AMINO-1-(4-CHLOROPHENYL)-3-METHYLPYRAZOLE-4-CARBONITRILE;DTXSID80484945;MFCD08459268;AKOS015854719;LS-11169;CS-0210297;F97587;A832024;5-amino-1-(4-chlorophenyl)-3-methyl-4-pyrazolecarbonitrile;5-azanyl-1-(4-chlorophenyl)-3-methyl-pyrazole-4-carbonitrile;5-amino-1-(4-chloro-phenyl)-3-methyl-1h-pyrazole-4-carbonitrile

Suppliers and Price of 5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-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

TRC
5-Amino-4-cyano-1-(4-chlorophenyl)-3-methylpyrazole
100mg
$ 50.00

TRC
5-Amino-4-cyano-1-(4-chlorophenyl)-3-methylpyrazole
1g
$ 220.00

Matrix Scientific
5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile
1g
$ 200.00

Matrix Scientific
5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile
500mg
$ 160.00

Crysdot
5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile 95+%
5g
$ 339.00

Chemenu
5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile 95%
5g
$ 320.00

American Custom Chemicals Corporation
5-AMINO-1-(4-CHLOROPHENYL)-3-METHYL-1H-PYRAZOLE-4-CARBONITRILE 95.00%
5MG
$ 498.99

Alichem
5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile
5g
$ 400.00

AK Scientific
5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile
5g
$ 584.00

Total 17 raw suppliers

Chemical Property of 5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile

Chemical Property:

Melting Point:175-178 °C
Boiling Point:430.6±45.0 °C(Predicted)
PKA:-0.68±0.10(Predicted)
PSA：67.63000
Density:1.36±0.1 g/cm3(Predicted)
LogP:2.86918
Storage Temp.:2-8°C
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:232.0515740
Heavy Atom Count:16
Complexity:292

Purity/Quality:

≥95% ^*data from raw suppliers

5-Amino-4-cyano-1-(4-chlorophenyl)-3-methylpyrazole ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=NN(C(=C1C#N)N)C2=CC=C(C=C2)Cl

Technology Process of 5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile

There total 3 articles about 5-Amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-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: 86.0%

: 1073-70-7
4-chlorophenylhydrazine hydrochloride

: 5417-82-3
(1-ethoxyethylidene)malononitrile

: 58791-82-5
5-amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile

Guidance literature:: With sodium acetate; In ethanol; for 1h; Reflux;
DOI:10.1016/j.bmcl.2013.09.062

Reference yield:

: 63917-11-3
(ethoxyethylidene)malononitrile

: 1073-70-7
4-chlorophenylhydrazine hydrochloride

: 58791-82-5
5-amino-1-(4-chlorophenyl)-3-methyl-1H-pyrazole-4-carbonitrile

Guidance literature:: 4-chlorophenylhydrazine hydrochloride; With sodium acetate; In ethanol; for 0.5h; Reflux;

(ethoxyethylidene)malononitrile; for 2h; Reflux;
DOI:10.21577/0103-5053.20180150