4-(3-Chlorophenyl)-3-methyl-1H-pyrazol-5-amine

Base Information

Chemical Name:4-(3-Chlorophenyl)-3-methyl-1H-pyrazol-5-amine
CAS No.:62538-18-5
Molecular Formula:C10H10ClN3
Molecular Weight:207.662
Hs Code.:2933199090
ChEMBL ID:CHEMBL4292952
DSSTox Substance ID:DTXSID20490520
Wikidata:Q82334328

Synonyms:4-(3-Chlorophenyl)-3-methyl-1H-pyrazol-5-amine;62538-18-5;4-(3-Chlorophenyl)-5-methyl-1H-pyrazol-3-amine;CHEMBL4292952;DTXSID20490520;MFCD09438994;AKOS000302222;AKOS008124417;AKOS022304209;LS-12268;BB 0260654;CS-0263669;EN300-88760;Z1262237268;4-(3-CHLOROPHENYL)-3-METHYL-1H-PYRAZOL-5-YLAMINE

Suppliers and Price of 4-(3-Chlorophenyl)-3-methyl-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

ChemBridge Corporation
4-(3-chlorophenyl)-3-methyl-1H-pyrazol-5-aminehydrobromide 95%
250 mg
$ 99.00

American Custom Chemicals Corporation
4-(3-CHLOROPHENYL)-3-METHYL-1H-PYRAZOL-5-AMINE 95.00%
5MG
$ 505.59

AK Scientific
4-(3-Chlorophenyl)-3-methyl-1H-pyrazol-5-amine
5g
$ 653.00

Total 3 raw suppliers

Chemical Property of 4-(3-Chlorophenyl)-3-methyl-1H-pyrazol-5-amine

Chemical Property:

Boiling Point:398.8±42.0 °C(Predicted)
PKA:15.28±0.50(Predicted)
PSA：55.43000
Density:1.324±0.06 g/cm3(Predicted)
LogP:2.55080
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:207.0563250
Heavy Atom Count:14
Complexity:200

Purity/Quality:

99% ^*data from raw suppliers

4-(3-chlorophenyl)-3-methyl-1H-pyrazol-5-aminehydrobromide 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(=NN1)N)C2=CC(=CC=C2)Cl

Technology Process of 4-(3-Chlorophenyl)-3-methyl-1H-pyrazol-5-amine

There total 3 articles about 4-(3-Chlorophenyl)-3-methyl-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: 71.0%

: 14123-79-6
2-(3-chloro-phenyl)-acetoacetonitrile

: 62538-18-5
4-(3-chlorophenyl)-5-methyl-1H-pyrazol-3-amine

Guidance literature:: With hydrazine hydrate; acetic acid; In ethanol; at 50 ℃; for 7h; Reflux;
DOI:10.1134/S1070428014030191

Reference yield:

: 1529-41-5
3-chloro-benzeneacetonitrile

: 62538-18-5
4-(3-chlorophenyl)-5-methyl-1H-pyrazol-3-amine

Guidance literature:: Multi-step reaction with 2 steps

1.1: sodium hydride / mineral oil; tetrahydrofuran / 0.08 h

1.2: 60 °C

2.1: hydrazine dihydrochloride / ethanol / Reflux; Molecular sieve

With hydrazine dihydrochloride; sodium hydride; In tetrahydrofuran; ethanol; mineral oil; 1.2: |Claisen Condensation;
DOI:10.1039/c8md00068a