Acetamide, N-(4-((methylamino)sulfonyl)phenyl)-

Base Information

• Chemical Name: Acetamide, N-(4-((methylamino)sulfonyl)phenyl)-
• CAS No.: 6884-87-3
• Molecular Formula: C9H12N2O3S
• Molecular Weight: 228.272
• DSSTox Substance ID: DTXSID80218944
• Nikkaji Number: J590.813B
• Wikidata: Q83095856
• Mol file: 6884-87-3.mol

Synonyms:6884-87-3;CCRIS 6816;N-[4-(methylsulfamoyl)phenyl]acetamide;N-(4-(N-methylsulfamoyl)phenyl)acetamide;N4-Acetyl-N'-methylsulfanilamide;N4-Acetyl-N1-methylsulfanilamide;Acetamide, N-(4-((methylamino)sulfonyl)phenyl)-;BRN 2697708;N-(4-((Methylamino)sulfonyl)phenyl)acetamide;N(sup 4)-Acetyl-N(sup 1)-methylsulfanilamide;Acetamide, N-[4-[(methylamino)sulfonyl]phenyl]-;Oprea1_674183;SCHEMBL1102020;DTXSID80218944;n-(4-methylsulfamoylphenyl)acetamide;MFCD00447649;STK416453;AKOS003277573;4-acetamido-N-methylbenzenesulphonamide;CCG-283111;LS-9870;n-(4-methylsulfamoyl-phenyl)-acetamide;N-methyl-4-(acetamido)benzenesulfonamide;4-(Acetylamino)-N-methylbenzenesulfonamide;CS-0326637;acetamide,N-[4-[(methylamino)sulfonyl]phenyl]-;Z32498194;F0808-1493

Chemical Property of Acetamide, N-(4-((methylamino)sulfonyl)phenyl)-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 87.14000
• Density: 1.318g/cm³
• LogP: 2.67430
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 228.05686342
• Heavy Atom Count: 15
• Complexity: 313

Purity/Quality:

95% ^*data from raw suppliers

N-(4-Methylsulfamoyl-phenyl)-acetamide 95%+ ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC

Technology Process of Acetamide, N-(4-((methylamino)sulfonyl)phenyl)-

There total 7 articles about Acetamide, N-(4-((methylamino)sulfonyl)phenyl)- 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: 72.4%

N-methyl-4-aminobenzenesulfonamide (1709-52-0) + acetyl chloride (75-36-5) → N-methyl-4-(acetamido)benzenesulfonamide (6884-87-3)

Guidance literature:

With potassium carbonate; In acetone; at 0 - 30 ℃; for 11h;

DOI:10.1007/s11164-011-0327-6

Reference yield: 70.0%

methylamine (74-89-5) + p-acetylaminobenzenesulfonyl chloride (121-60-8) → N-methyl-4-(acetamido)benzenesulfonamide (6884-87-3)

Guidance literature:

In tetrahydrofuran; dichloromethane; at 20 ℃; for 0.5h;

DOI:10.1016/j.ejmech.2013.10.058

Reference yield: 60.0%

methylamine hydrochloride (593-51-1) + p-acetylaminobenzenesulfonyl chloride (121-60-8) → N-methyl-4-(acetamido)benzenesulfonamide (6884-87-3)

Guidance literature:

With sodium carbonate; In water; at 0 - 80 ℃; for 3h;

DOI:10.3390/molecules23123152

upstream raw materials:

methylamine

p-acetylaminobenzenesulfonyl chloride

N-methyl-4-aminobenzenesulfonamide

acetyl chloride

Downstream raw materials:

C₇H₁₀N₂O₂S*ClH

sulfanilic acid-[(2,6-dimethyl-pyrimidin-4-yl)-methyl-amide]

4-amino-N-methyl-N-(thiazol-2-yl)benzenesulfonamide

bis-(N-acetyl-sulfanilyl)-methyl-amine

Refernces

• 1、 Barbosa, Maria Letícia De Castro,Lima, Lídia Moreira,Tesch, Roberta,Sant'Anna, Carlos Mauricio R.,Totzke, Frank,Kubbutat, Michael H.G.,Sch?chtele, Christoph,Laufer, Stefan A.,Barreiro, Eliezer J.. "Novel 2-chloro-4-anilino-quinazoline derivatives as EGFR and VEGFR-2 dual inhibitors". . p. 1 - 14. Retrieved 2013/12/04.
• 2、 -. "SUBSTITUTED CINNAMIC, ACID GUANIDIDES, PROCESS FOR THEIR PREPARATION, THEIR USE AS A MEDICAMENT, AND MEDICAMENT COMPRISING THEM". . . Retrieved 2008/06/13.