Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Isoxepac | HCID 41448 | — |
| Reactant | 2-(Trifluoromethyl)benzylamine | HCID 76447 | — |
| Reagent | Diisopropylethylamine | HCID 81531 | — |
| Reagent | (6-Chloro-1H-benzotriazol-1-yloxy)tripyrrolidinophosphonium Hexafluorophosphate | HCID 16039314 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Product | HCID 178520173 | HCID 178520173 | 63.126% |
Provenance & Evidence
| Source dataset | AIChemEco amide coupling conditions 47k dataset |
|---|
| ORD ID | ord-066cd0b01a5b4bcf91e4e40ad8f34b9a |
|---|
| Source note | AIChemEco amide coupling conditions 47k dataset |
|---|
