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: | 2002 | |
|---|---|---|
| Name: | tridecafluoroheptanoic acid | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: perfluoro-n-heptanoic acid | |
| Labels: | ||
| CAS: | 375-85-9 | |
| InChi Code: | InChI=1S/C7HF13O2/c8-2(9,1(21)22)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h(H,21,22) |
Properties
M16.logVP: Vapor pressure as log(VP) [log(mm Hg)]
| Value | Source or prediction |
|---|---|
| -0.803 |
experimental value |
| -1.0445 |
Tab2.Model_16: PFC vapor pressure (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID1037303 | US EPA CompTox Dashboard |