n-(3-Acetamidophenyl)-4-methyl-3-nitrobenzamide

Base Information

• Chemical Name: n-(3-Acetamidophenyl)-4-methyl-3-nitrobenzamide
• CAS No.: 5545-94-8
• Molecular Formula: C₂₀H₂₂N₂O₂
• Molecular Weight: 322.407
• DSSTox Substance ID: DTXSID40970793
• Wikidata: Q82954046
• ChEMBL ID: CHEMBL1452336
• Mol file: 5545-94-8.mol

Synonyms:N-[3-(acetylamino)phenyl]-4-methyl-3-nitrobenzamide;N-(3-(ACETYLAMINO)PHENYL)-4-METHYL-3-NITROBENZAMIDE;n-(3-acetamidophenyl)-4-methyl-3-nitrobenzamide;Cambridge id 5545948;Oprea1_472858;MLS000722837;CHEMBL1452336;DTXSID40970793;HMS2598J21;STK084574;AKOS003260357;SMR000304833;AB00088386-01;SR-01000407222;SR-01000407222-1;N-{3-[(1-Hydroxyethylidene)amino]phenyl}-4-methyl-3-nitrobenzene-1-carboximidic acid

Chemical Property of n-(3-Acetamidophenyl)-4-methyl-3-nitrobenzamide

Chemical Property:

• Vapor Pressure: 2.32E-09mmHg at 25°C
• Boiling Point: 479.7°Cat760mmHg
• Flash Point: 243.9°C
• PSA: 45.33000
• Density: 1.365g/cm³
• LogP: 3.14420
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 313.10625597
• Heavy Atom Count: 23
• Complexity: 463

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)C(=O)NC2=CC=CC(=C2)NC(=O)C)[N+](=O)[O-]

Technology Process of n-(3-Acetamidophenyl)-4-methyl-3-nitrobenzamide

There total 1 articles about n-(3-Acetamidophenyl)-4-methyl-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:

Tetrahydro-selamin (5523-37-5,34384-71-9,93862-63-6,93862-64-7) → (11aS,12aS)-11-Eth-(Z)-ylidene-5,6,7,7a,10,11,11a,12,12a,13-decahydro-9-oxa-6a,13-diaza-indeno[2,1-a]anthracen-8-one (5545-94-8)

Guidance literature:

With sodium tetrahydroborate; In acetic acid;

DOI:10.1021/ja00960a037

upstream raw materials:

Tetrahydro-selamin