Bagheri, M.; Borhani, T. N. G.; Zahedi, G. Estimation of flash point and autoignition temperature of organic sulfur chemicals. Energy Convers. Manage. 2012, 58, 185–196.
Compound
| ID: | 25103-58-6 | |
|---|---|---|
| Name: | Tert-dodecyl mercaptan | |
| Description: | ||
| Labels: | Mercaptans | |
| CAS: | 25103-58-6 | |
| InChi Code: | InChI=1S/C12H26S/c1-9(2)10(3,4)11(5,6)12(7,8)13/h9,13H,1-8H3 |
Properties
FP: Flash point [K]
| Value | Source or prediction |
|---|---|
| 373 |
experimental value |
| 393 |
Eq6: PSO-MLR model for flash point (Validation set) |
| 386 |
Tab5: FFNN model for flash point (Validation set) |
AIT: Auto-Ignition Temperature [K]
| Value | Source or prediction |
|---|---|
| 497 |
Eq7: PSO-MLR model for auto-ignition temperature (Prediction set) |
| 510 |
Tab6: FFNN model for auto-ignition temperature (Prediction set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID1025221 | US EPA CompTox Dashboard |