Table 2.
EcoScale calculations and results for the synthesis of 2a and 3a [75].
| synthesis of 2a | ||
|
| ||
| parameter | parameter details | penalty points |
|
| ||
| yield | 91% | 4.5 |
| price of reaction components to obtain 10 mmol of product | 1a | 0 |
| DBSA | 0 | |
| safety | DBSA | 0 |
| technical setup | common setup | 0 |
| temperature, time | heating, >1 h | 3 |
| workup and purification | classical chromatography | 10 |
| EcoScale score | 82.5 | |
|
| ||
| synthesis of 3a | ||
|
| ||
| parameter | parameter details | penalty points |
|
| ||
| yield | 90% | 5 |
| price of reaction components to obtain 10 mmol of product | 1a | 0 |
| PEG-400 | 0 | |
| NaOH | 0 | |
| safety | PEG-400 | 0 |
| NaOH | 5 (dangerous for environment) | |
| technical setup | common setup | 0 |
| temperature, time | heating, >1 h | 3 |
| workup and purification | classical chromatography | 10 |
| EcoScale score | 77.0 | |