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: | 2003 | |
|---|---|---|
| Name: | heptadecafluorononanoic acid | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: perfluoro-n-nonanoic acid | |
| Labels: | ||
| CAS: | 375-95-1 | |
| InChi Code: | InChI=1S/C9HF17O2/c10-2(11,1(27)28)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)26/h(H,27,28) |
Properties
M16.logVP: Vapor pressure as log(VP) [log(mm Hg)]
| Value | Source or prediction |
|---|---|
| -2.011 |
experimental value |
| -1.8613 |
Tab2.Model_16: PFC vapor pressure (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID8031863 | US EPA CompTox Dashboard |