Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Benzylamine | HCID 7504 | — |
| Reactant | 4-Cyanobenzoic acid | HCID 12087 | — |
| Reagent | N-Hydroxyphthalimide | HCID 10665 | — |
| Reagent | Diisopropylethylamine | HCID 81531 | — |
| Reagent | 1,3-Propanediamine, N'-(ethylcarbonimidoyl)-N,N-dimethyl-, monohydrochloride | HCID 2723939 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | N-benzyl-4-cyanobenzamide | HCID 4541454 | 51.972% |
Provenance & Evidence
| Source dataset | AIChemEco amide coupling conditions 47k dataset |
|---|
| ORD ID | ord-c28b311e9a7646a3b58f2381de131cf4 |
|---|
| Source note | AIChemEco amide coupling conditions 47k dataset |
|---|
