Ethanethioic acid, ((3-methylphenyl)amino)-, S-1H-benzimidazol-2-yl ester

Base Information

• Chemical Name: Ethanethioic acid, ((3-methylphenyl)amino)-, S-1H-benzimidazol-2-yl ester
• CAS No.: 83408-78-0
• Molecular Formula: C₁₆H₁₅N₃OS
• Molecular Weight: 297.381
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID20232326
• Wikidata: Q83113349
• Mol file: 83408-78-0.mol

Synonyms:BRN 4518988;83408-78-0;Ethanethioic acid, ((3-methylphenyl)amino)-, S-1H-benzimidazol-2-yl ester;((3-Methylphenyl)amino)ethanethioic acid S-1H-benzimidazol-2-yl ester;DTXSID20232326;LS-65740

Chemical Property of Ethanethioic acid, ((3-methylphenyl)amino)-, S-1H-benzimidazol-2-yl ester

Chemical Property:

• Vapor Pressure: 1.9E-12mmHg at 25°C
• Boiling Point: 557.1°C at 760 mmHg
• PKA: 9.98±0.10(Predicted)
• Flash Point: 290.7°C
• PSA: 83.08000
• Density: 1.32g/cm³
• LogP: 3.67510
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 297.09358328
• Heavy Atom Count: 21
• Complexity: 365

Purity/Quality:

((3-METHYLPHENYL)AMINO)ETHANETHIOIC ACID S-1H-BENZIMIDAZOL-2-YL ESTER 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)NCC(=O)SC2=NC3=CC=CC=C3N2

Technology Process of Ethanethioic acid, ((3-methylphenyl)amino)-, S-1H-benzimidazol-2-yl ester

There total 1 articles about Ethanethioic acid, ((3-methylphenyl)amino)-, S-1H-benzimidazol-2-yl ester 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:

1-amino-3-methylbenzene (108-44-1) + 2-(Chloroacetylmercapto)benzimidazole (37061-45-3) → m-Tolylamino-thioacetic acid S-(1H-benzoimidazol-2-yl) ester (83408-78-0)

Guidance literature:

With triethylamine; In ethanol; for 2h; Heating;

upstream raw materials:

1-amino-3-methylbenzene

2-(Chloroacetylmercapto)benzimidazole

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 83408-78-0 ((3-Methylphenyl)amino)ethanethioic acid S-1H-benzimidazol-2-yl ester

Send

Send

Metric Ton KG G Pound L ML

Send

Send