Tulp, I.; Tamm, T.; Karelson, G.; Dobchev, D.; Martin, D.; Tämm, K.; Savchenko, D.; Jänes, J.; Härk, E.; Kreegipuu, A.; Karelson, M. QSAR for abiotic degradation in air. Q13-22a-0034. Molcode Ltd., 2010.
Compound
| ID: | 201 | |
|---|---|---|
| Name: | 3-pentanone | |
| Description: | ||
| Labels: | ||
| CAS: | 96-22-0 | |
| InChi Code: | InChI=1S/C5H10O/c1-3-5(6)4-2/h3-4H2,1-2H3 |
Properties
logT(0.5): Degradation half-life in air [log(h)]
| Value | Source or prediction |
|---|---|
| 1.74 |
experimental value |
| 1.44 |
QSAR: Model for degradation half-life (Test set) |