Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Chloride | HCID 312 | — |
| Reactant | Hydrochloric Acid | HCID 313 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Toluene | HCID 1140 | — |
| Reactant | Nitroethane | HCID 6587 | — |
| Reactant | Butylamine | HCID 8007 | — |
| Reactant | Iron | HCID 23925 | — |
| Reactant | Ferric cation | HCID 29936 | — |
| Reactant | 3-Bromo-4-methoxybenzaldehyde | HCID 98662 | — |
| Reactant | HCID 2826087 | HCID 2826087 | — |
| Product | (5-Bromo-2-methoxyphenyl)acetone | HCID 22388465 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (5/10) |
|---|
| ORD ID | ord-f2457347d3ed4ca6a3bfd1115d9df87a |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (5/10) |
|---|
