NSC-41589

Base Information

• Chemical Name: NSC-41589
• CAS No.: 6310-41-4
• Molecular Formula: C9H11 N O S
• Molecular Weight: 181.258
• Hs Code.: 2930909090
• Mol file: 6310-41-4.mol

Synonyms:Acetanilide,2'-(methylthio)- (6CI,7CI,8CI); 2'-Methylthioacetanilide;N-Acetyl-2-(methylthio)aniline; NSC 41589

Chemical Property of NSC-41589

Chemical Property:

• Vapor Pressure: 5.62E-05mmHg at 25°C
• Boiling Point: 346.8°Cat760mmHg
• Flash Point: 163.5°C
• PSA: 54.40000
• Density: 1.14g/cm³
• LogP: 2.43990

Purity/Quality:

99% ^*data from raw suppliers

NSC-41589 >98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of NSC-41589

There total 11 articles about NSC-41589 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: 98.0%

1-[2-(methylsulfanyl)phenyl]diazonium tetrafluoroborate + acetonitrile (75-05-8,26809-02-9) → N-(2-methylsulfanyl-phenyl)-acetamide (6310-41-4)

Guidance literature:

1-[2-(methylsulfanyl)phenyl]diazonium tetrafluoroborate; acetonitrile; for 0.0166667h; Microwave irradiation;

With water; In diethyl ether;

Reference yield: 97.0%

acetic anhydride (108-24-7) + 2-(Methylthio)aniline (2987-53-3) → N-(2-methylsulfanyl-phenyl)-acetamide (6310-41-4)

Guidance literature:

With triethylamine; In chloroform; at 20 - 90 ℃; for 2 - 3h; Product distribution / selectivity;

Reference yield: 89.0%

1,3-Benzothiazole (95-16-9) + dimethylsulfite (616-42-2) → N-(2-methylsulfanyl-phenyl)-acetamide (6310-41-4)

Guidance literature:

With iodine; sodium ethanolate; In N,N-dimethyl acetamide; at 80 ℃; for 24h;

upstream raw materials:

acetic anhydride

2-(Methylthio)aniline

acetyl chloride

2-amino-benzenethiol

Downstream raw materials:

S-(2-aminophenyl)-S-methylsulfoximine

N-{3-[(1R,2S,7R,8S)-3-(4-fluoro-benzyl)-6-hydroxy-4-oxo-3-aza-tricyclo[6.2.1.0^2,7]undec-5-en-5-yl]-1-methyl-1-oxo-1λ⁶-benzo[1,2,4]thiadiazin-7-yl}-methanesulfonamide

N-{3-[(1S,2R,7S,8R)-3-(4-fluoro-benzyl)-6-hydroxy-4-oxo-11-oxa-3-aza-tricyclo[6.2.1.0^2,7]undec-5-en-5-yl]-1-methyl-1-oxo-1λ⁶-benzo[1,2,4]thiadiazin-7-yl}-methanesulfonamide

(1S,2R,3S,4R)-3-{(4-fluoro-benzyl)-[2-(1-methyl-7-nitro-1-oxo-1λ⁶-benzo[1,2,4]thiadiazin-3-yl)-acetyl]-amino}-bicyclo[2.2.1]heptane-2-carboxylic acid ethyl ester

Refernces

• 1、 -. "Preparation method and purification method of N-(2-(methylthio)phenyl)acetamide compound". Paragraph 0022. . Retrieved 2020/02/14.
• 2、 Kalla, Reddi Mohan Naidu,Lim, Jaehwa,Bae, Jaeyeong,Kim, Il. "Sulfated choline ionic liquid-catalyzed acetamide synthesis by grindstone method". supporting information. p. 1595 - 1599. Retrieved 2017/04/03.