N-(3-chlorophenyl)-2-methyl-4-nitropyrazole-3-carboxamide

Base Information

Chemical Name:N-(3-chlorophenyl)-2-methyl-4-nitropyrazole-3-carboxamide
CAS No.:311813-99-7
Molecular Formula:C₁₁H₉ClN₄O₃
Molecular Weight:280.67
Hs Code.:
DSSTox Substance ID:DTXSID801328235
ChEMBL ID:CHEMBL1562784

Synonyms:N-(3-chlorophenyl)-1-methyl-4-nitro-1H-pyrazole-5-carboxamide;Oprea1_529062;Oprea1_836363;MLS001202841;CHEMBL1562784;N-(3-chlorophenyl)-2-methyl-4-nitropyrazole-3-carboxamide;DTXSID801328235;HMS2821H11;STL297681;2-Methyl-4-nitro-2H-pyrazole-3-carboxylic acid (3-chloro-phenyl)-amide;AKOS000669099;CCG-105043;311813-99-7;SMR000514425;SR-01000411196;SR-01000411196-1;N-(3-chlorophenyl)-2-methyl-4-nitro-pyrazole-3-carboxamide

Suppliers and Price of N-(3-chlorophenyl)-2-methyl-4-nitropyrazole-3-carboxamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of N-(3-chlorophenyl)-2-methyl-4-nitropyrazole-3-carboxamide

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:280.0363179
Heavy Atom Count:19
Complexity:362

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=CC(=CC=C2)Cl

Technology Process of N-(3-chlorophenyl)-2-methyl-4-nitropyrazole-3-carboxamide

There total 3 articles about N-(3-chlorophenyl)-2-methyl-4-nitropyrazole-3-carboxamide 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:

: 16034-46-1
1-methyl-1H-pyrazole-5-carboxylic acid

: 311813-99-7
2-methyl-4-nitro-2H-pyrazole-3-carboxylic acid (3-chloro-phenyl)-amide

Guidance literature:: Multi-step reaction with 3 steps

1: H₂SO₄; HNO₃ / Heating

2: SOCl₂ / Heating

3: Et₃N

With thionyl chloride; sulfuric acid; nitric acid; triethylamine;
DOI:10.1016/j.bmcl.2006.11.087

Reference yield:

: 92534-69-5
1-methyl-4-nitro-1H-pyrazole-5-carboxylic acid

: 311813-99-7
2-methyl-4-nitro-2H-pyrazole-3-carboxylic acid (3-chloro-phenyl)-amide

Guidance literature:: Multi-step reaction with 2 steps

1: SOCl₂ / Heating

2: Et₃N

With thionyl chloride; triethylamine;
DOI:10.1016/j.bmcl.2006.11.087