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: | 255 | |
|---|---|---|
| Name: | 2-Nitrobiphenyl | |
| Description: | ||
| Labels: | Testing | |
| CAS: | 86-00-0 | |
| InChi Code: | InChI=1S/C12H9NO2/c14-13(15)12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9H |
Properties
Tb: Boiling point [°C]
| Value | Source or prediction |
|---|---|
| 325 |
experimental value |
| 336.7 |
Tab7_Tb: RBF-NN model for diverse chemicals (Testing set) |
Tf: Flash point [°C]
| Value | Source or prediction |
|---|---|
| 179 |
experimental value |
| 185 |
Tab7_Tf: RBF-NN model for diverse chemicals (Testing set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID9025746 | US EPA CompTox Dashboard |