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: | 134 | |
|---|---|---|
| Name: | Methyl vinyl ketone | |
| Description: | ||
| Labels: | Validation | |
| CAS: | 78-94-4 | |
| InChi Code: | InChI=1S/C4H6O/c1-3-4(2)5/h3H,1H2,2H3 |
Properties
Tb: Boiling point [°C]
| Value | Source or prediction |
|---|---|
| 81.4 |
experimental value |
| 75.8 |
Tab7_Tb: RBF-NN model for diverse chemicals (Validation set) |
Tf: Flash point [°C]
| Value | Source or prediction |
|---|---|
| -7 |
experimental value |
| -4.6 |
Tab7_Tf: RBF-NN model for diverse chemicals (Validation set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID3025671 | US EPA CompTox Dashboard |