2178-86-1

Basic information

• Product Name: 2-CARBETHOXYTHIOBENZTHIAZOLE
• Synonyms: 2-CARBETHOXYTHIOBENZTHIAZOLE;ETHYL (2-BENZOTHIAZOLYLTHIO)-FORMATE;S-(BENZOTHIAZOL-2-YL) ETHYL THIOCARBONATE
• CAS NO: 2178-86-1
• Molecular Formula: C₁₀H₉NO₂S₂
• Molecular Weight: 239.31396
• Mol File: 2178-86-1.mol
• Article Data: 4

Chemical Properties

• Melting Point: 65 °C
• Boiling Point: 359.6±25.0 °C(Predicted)
• Appearance: /
• Density: 1.37±0.1 g/cm3(Predicted)
• PKA: -0.77±0.10(Predicted)
• CAS DataBase Reference: 2-CARBETHOXYTHIOBENZTHIAZOLE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-CARBETHOXYTHIOBENZTHIAZOLE(2178-86-1)
• EPA Substance Registry System: 2-CARBETHOXYTHIOBENZTHIAZOLE(2178-86-1)

Safety Data

• Hazardous Substances Data: 2178-86-1(Hazardous Substances Data)

Upstream product

• 541-41-3 chloroformic acid ethyl ester 
• 2492-26-4 sodium 2-mercaptobenzothiazole 
• 7778-70-3 potassium 2-mercaptobenzothiazolate 
• 149-30-4 2-Mercaptobenzothiazole 

Downstream Products

• 57392-05-9 2-(Hydrazinocarbonylthio)benzthiazol 
• 57391-95-4 N'-(phenyl-thiocarbamoyl)-hydrazinecarbothioic acid S-benzothiazol-2-yl ester 
• 57392-03-7 N'-[(4-iodo-phenyl)-thiocarbamoyl]-hydrazinecarbothioic acid S-benzothiazol-2-yl ester 
• 57391-98-7 N'-(m-tolyl-thiocarbamoyl)-hydrazinecarbothioic acid S-benzothiazol-2-yl ester 
• 57391-97-6 N'-(p-tolyl-thiocarbamoyl)-hydrazinecarbothioic acid S-benzothiazol-2-yl ester 
• 57392-01-5 N'-[(4-chloro-phenyl)-thiocarbamoyl]-hydrazinecarbothioic acid S-benzothiazol-2-yl ester 
• 57392-02-6 N'-[(4-bromo-phenyl)-thiocarbamoyl]-hydrazinecarbothioic acid S-benzothiazol-2-yl ester 
• 57391-96-5 N'-(o-tolyl-thiocarbamoyl)-hydrazinecarbothioic acid S-benzothiazol-2-yl ester 
• 57392-00-4 N'-[(4-methoxy-phenyl)-thiocarbamoyl]-hydrazinecarbothioic acid S-benzothiazol-2-yl ester 
• 57391-99-8 N'-[(2-methoxy-phenyl)-thiocarbamoyl]-hydrazinecarbothioic acid S-benzothiazol-2-yl ester 

Relevant articles and documents

Synthesis and structural elucidation of amino acetylenic and thiocarbamates derivatives for 2-mercaptobenzothiazole as antimicrobial agents

Objective: To design and synthesize amino acetylenic and thiocarbonate of 2-mercapto-1,3-benthiazoles as potential antimicrobial agents. Methods: A new series of 2-{[4-(t-amino-1-yl) but-2-yn-1-yl] sulfanyl}-1,3-benzothiazole derivatives (AZ1-AZ6), and S-1,3-benzothiazol-2-yl-O-alkyl carbonothioate derivatives were synthesised, with the aim that the target compounds show new and potential antimicrobial activity. The elemental analysis was indicated by the EuroEA elemental analyzer, and biological characterization was via IR,1H-NMR, [13]C-NMR, DSC were determined with the aid of Bruker FT-IR and Varian 300 MHz spectrometer using DMSO-d6 as a solvent. In vitro antimicrobial activity, evaluation was done for the synthesised compounds, by agar diffusion method and broth dilution test. The minimum inhibitory concentration (MIC) and the minimum bactericidal concentration (MBC) were determined. Results: The IR,1H-NMR,13C-NMR, DSC and elemental analysis were consistent with the assigned structures. Compound of 2-{[4-(4-methylpiperazin-1-yl)but-2-yn-1-yl] sulfanyl}-1,3-benzothiazole (AZ1), 2-{[4-(2-methylpiperidin-1-yl)but-2-yn-1-yl]sulfanyl}-1,3-benzothiazole (AZ2), 2-{[4-(piperidin-1-yl) but-2-yn-1-yl]sulfanyl}-1, 3-benzothiazole (AZ6), S-1,3-benzothiazol-2-yl-O-ethyl carbonothioate (AZ7), and S-1,3- benzothiazol-2-yl-O-(2-methylpropyl) carbonothioate (AZ9) showed the highest antimicrobial activity against Pseudomonas aeruginosa (P. aeruginosa), AZ-9 demonstrated the highest antifungal activity against Candida albicans (C. albicans), with MIC of 31.25 μg/ml. Conclusion: These promising results promoted our interest to investigate other structural analogues for their antimicrobial activity further.

Synthesis of 2-mercaptobenzothiazole and of 2-mercaptobenzemidazole derivatives using polymer-supported anions

-