N-(4,6-dimethyl-2-pyridinyl)-3-nitrobenzamide

Base Information

Chemical Name:N-(4,6-dimethyl-2-pyridinyl)-3-nitrobenzamide
CAS No.:94843-51-3
Molecular Formula:C14H13N3O3
Molecular Weight:271.276
Hs Code.:
DSSTox Substance ID:DTXSID301252112
Nikkaji Number:J624.757A
ChEMBL ID:CHEMBL422164
Mol file:94843-51-3.mol

Synonyms:N-(4,6-dimethyl-2-pyridinyl)-3-nitrobenzamide;N-(4,6-dimethylpyridin-2-yl)-3-nitrobenzamide;Cambridge id 7222012;Oprea1_170848;MLS000626911;CHEMBL422164;SCHEMBL10090736;DTXSID301252112;HMS2579K21;STK419549;AKOS003288293;SMR000272053;N-(4,6-Dimethyl-2-pyridyl)-3-nitrobenzamide;AK-968/15360055;SR-01000254835;SR-01000254835-1;94843-51-3

Suppliers and Price of N-(4,6-dimethyl-2-pyridinyl)-3-nitrobenzamide

Supply Marketing:

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

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Chemical Property of N-(4,6-dimethyl-2-pyridinyl)-3-nitrobenzamide

Chemical Property:

Melting Point:150 °C (H2O)
PSA：87.81000
LogP:3.45510
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:271.09569129
Heavy Atom Count:20
Complexity:369

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC(=NC(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C

Technology Process of N-(4,6-dimethyl-2-pyridinyl)-3-nitrobenzamide

There total 2 articles about N-(4,6-dimethyl-2-pyridinyl)-3-nitrobenzamide 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: 75.4%

: 5407-87-4
2-Amino-4,6-dimethylpyridine

: 121-90-4
m-nitrobenzoic acid chloride

: 94843-51-3
N-(4,6-dimethyl-2-pyridinyl)-3-nitrobenzamide

Guidance literature:: With triethylamine; In 1,2-dichloro-ethane; for 1h;
DOI:10.1021/jm50001a004

Reference yield:

: 121-92-6
3-nitrobenzoic acid

: 94843-51-3
N-(4,6-dimethyl-2-pyridinyl)-3-nitrobenzamide

Guidance literature:: Multi-step reaction with 2 steps

1: thionyl chloride / 2 h / Heating

2: triethylamine / 1,2-dichloro-ethane / 5 h / Ambient temperature

With thionyl chloride; triethylamine; In 1,2-dichloro-ethane;
DOI:10.1016/0223-5234(94)90107-4