Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Acetate | HCID 175 | — |
| Reactant | Potassium Cation | HCID 813 | — |
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Toluene | HCID 1140 | — |
| Reactant | Ethyl Acetate | HCID 8857 | — |
| Reactant | Carbonate Ion | HCID 19660 | — |
| Reactant | 1,4-Dioxane | HCID 31275 | — |
| Reactant | 5-Bromothiophene-2-carbonitrile | HCID 3595059 | — |
| Reactant | 4-Bromo-1-(2-methylpropoxy)-2-nitrobenzene | HCID 61375112 | — |
| Reactant | HCID 178420554 | HCID 178420554 | — |
| Product | HCID 69008678 | HCID 69008678 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
| ORD ID | ord-9e4efcef3fa140a3919bdea2ee7759e3 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (10/10) |
|---|
