Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Acetic Acid | HCID 176 | — |
| Reactant | Benzene | HCID 241 | — |
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | Water | HCID 962 | — |
| Reactant | Diethyl Ether | HCID 3283 | — |
| Reactant | Chloroform | HCID 6212 | — |
| Reactant | Tetrahydrofuran | HCID 8028 | — |
| Reactant | Borohydride | HCID 28123 | — |
| Reactant | 2-Oxopropyl decanoate | HCID 13750107 | — |
| Product | Propylene glycol 1-caprate | HCID 9816033 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (8/10) |
|---|
| ORD ID | ord-26cdf889c5c54bb481828d6d1bebfafa |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (8/10) |
|---|
