Tetteh, J.; Suzuki, T.; Metcalfe, E.; Howells, S. Quantitative Structure-Property Relationships for the Estimation of Boiling Point and Flash Point Using a Radial Basis Function Neural Network. J. Chem. Inf. Model. 1999, 39, 491-507.
Compound
| ID: | 95 | |
|---|---|---|
| Name: | 2-Naphtol | |
| Description: | ||
| Labels: | Validation | |
| CAS: | 135-19-3 | |
| InChi Code: | InChI=1S/C10H8O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7,11H |
Properties
Tb: Boiling point [°C]
| Value | Source or prediction |
|---|---|
| 296 |
experimental value |
| 243.1 |
Tab7_Tb: RBF-NN model for diverse chemicals (Validation set) |
Tf: Flash point [°C]
| Value | Source or prediction |
|---|---|
| 153 |
experimental value |
| 114.5 |
Tab7_Tf: RBF-NN model for diverse chemicals (Validation set) |