Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Acetate | HCID 175 | — |
| Reactant | Potassium Cation | HCID 813 | — |
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Ethyl Acetate | HCID 8857 | — |
| Reactant | 1,4-Dioxane | HCID 31275 | — |
| Reactant | Sulfate, hydrogen | HCID 61778 | — |
| Reactant | 7-Bromo-1-Chloroisoquinoline | HCID 6502024 | — |
| Product | 1-Chloroisoquinolin-7-ol | HCID 46835415 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (9/10) |
|---|
| ORD ID | ord-4dd0b2c8cfdf4c1188406fc1f6daece5 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (9/10) |
|---|
