| ID: | 100-53-8 | |
|---|---|---|
| Name: | Benzyl mercaptan | |
| Description: | ||
| Labels: | Mercaptans | |
| CAS: | 100-53-8 | |
| InChi Code: | InChI=1S/C7H8S/c8-6-7-4-2-1-3-5-7/h1-5,8H,6H2 |
FP: Flash point [K]
| Value | Source or prediction |
|---|---|
| 343 |
experimental value |
| 341 |
Eq6: PSO-MLR model for flash point (Training set) |
| 342 |
Tab5: FFNN model for flash point (Training set) |
AIT: Auto-Ignition Temperature [K]
| Value | Source or prediction |
|---|---|
| 541 |
Eq7: PSO-MLR model for auto-ignition temperature (Prediction set) |
| 550 |
Tab6: FFNN model for auto-ignition temperature (Prediction set) |
| Link | Resource description |
|---|---|
| DTXSID6026664 | US EPA CompTox Dashboard |