Gramatica, P.; Cassani, S.; Chirico, N. QSARINS-chem: Insubria datasets and new QSAR/QSPR models for environmental pollutants in QSARINS. J. Comput. Chem. 2014, 35, 1036–1044.
Compound
| ID: | 534 | |
|---|---|---|
| Name: | 2-methylbenzoic acid | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: benzoic acid, 2-methyl- | |
| Labels: | ||
| CAS: | 118-90-1 | |
| InChi Code: | InChI=1S/C8H8O2/c1-6-4-2-3-5-7(6)8(9)10/h2-5H,1H3,(H,9,10) |
Properties
M3.GHLI: Global half-life index i
| Value | Source or prediction |
|---|---|
| -1.59781 |
experimental value |
| -1.4901 |
Tab2.Model_3: Global half-life index (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID6026161 | US EPA CompTox Dashboard |