Benzamide, N,N-dimethyl-2-[(4-methyl-2-nitrophenyl)thio]-

Base Information

Chemical Name:Benzamide, N,N-dimethyl-2-[(4-methyl-2-nitrophenyl)thio]-
CAS No.:411208-40-7
Molecular Formula:C16H16N2O3S
Molecular Weight:316.381
Hs Code.:
DSSTox Substance ID:DTXSID20472528
Mol file:411208-40-7.mol

Synonyms:411208-40-7;Benzamide, N,N-dimethyl-2-[(4-methyl-2-nitrophenyl)thio]-;SCHEMBL1643390;DTXSID20472528;AKOS015963542

Suppliers and Price of Benzamide, N,N-dimethyl-2-[(4-methyl-2-nitrophenyl)thio]-

Supply Marketing:

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

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Chemical Property of Benzamide, N,N-dimethyl-2-[(4-methyl-2-nitrophenyl)thio]-

Chemical Property:

XLogP3:3.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:316.08816355
Heavy Atom Count:22
Complexity:411

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC(=C(C=C1)SC2=CC=CC=C2C(=O)N(C)C)[N+](=O)[O-]

Technology Process of Benzamide, N,N-dimethyl-2-[(4-methyl-2-nitrophenyl)thio]-

There total 5 articles about Benzamide, N,N-dimethyl-2-[(4-methyl-2-nitrophenyl)thio]- 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: 94.0%

: 5326-34-1
4-Bromo-3-nitrotoluene

: 20877-02-5
2-thio-N,N-dimethylbenzamide

: 411208-40-7
N,N-dimethyl-2-(4'-methyl-2'-nitrophenylthio)benzamide

Guidance literature:: With potassium carbonate; In N,N-dimethyl-formamide;

Reference yield:

: 506-59-2
N,N-dimethylammonium chloride

: 2-(4'-methyl-2'-nitrophenylthio)benzoic acid chloride

: 411208-40-7
N,N-dimethyl-2-(4'-methyl-2'-nitrophenylthio)benzamide

Guidance literature:: With potassium carbonate; In tetrahydrofuran; at 20 ℃;
DOI:10.1021/jm0400808

Reference yield:

: 5326-34-1
4-Bromo-3-nitrotoluene

: 411208-40-7
N,N-dimethyl-2-(4'-methyl-2'-nitrophenylthio)benzamide

Guidance literature:: Multi-step reaction with 3 steps

1: 86 percent / Cu; K₂CO₃ / dimethylformamide / 65 °C

2: SOCl₂ / 3 h / 70 °C

3: 2.04 g / K₂CO₃ / tetrahydrofuran / 20 °C

With thionyl chloride; copper; potassium carbonate; In tetrahydrofuran; N,N-dimethyl-formamide;
DOI:10.1021/jm0400808