Home
Guided Tour
PathFinder Cookbook
Subscribe
Utilities
Support
 
Secure ModeSecure Mode
Click to use (SSL)

Enter your Log in ID:
Enter Password:
By clicking on "Log In"
you are accepting the
Licence and Access terms


Pathfinder Cookbook - reaction details
Reaction id: 0208121012_14, verified by Personal Chemistry ©

1328

492
Ethanol

P2

Yield: 85%  Time: 300s   Temperature: 180 °C

Chemicals
 Name MW [g/mol] Density [g/ml] Amount [mmol] Mass/Volume
350469 141.101 1.000 0.400 56.440 mg
110894 85.150 0.869 0.800 78.389 µl
Ethanol 46.069 1.000 10.853 500.000 µl
Product 1 206.245 1.000 0.000 0.000 mg

Keywords
N-Arylation, Nucleophilic aromatic substitution

Comments
Synthesis: Running the reaction in NMP at 180°C for 300 s yielded 86% product according to LCMS. Running the reaction in MeOH at 140°C for 300 s yielded 81% product according to LCMS. Running the reaction in n-BuOH at 200°C for 300 s yielded 96% product according to LCMS.

Work-up and purification: After removing the solvent from the reaction mixture, the residue was purified by chromatography on silica, ethyl acetate:heptane, 1:2, giving a yellow solid.

Instrument Settings
Absorption level: Normal
Pre-stirring time: 0s

References
Hepperle, M.; Eckert, J.; Gala, D. Tetrahedron Lett. 1999, 40 (31), 5655-5659

Analysis
 Method Purity Files
 crude LCMS 98  0208121012_14A.pdf
 1H NMR  0208121012_14N_H.pdf