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: | 1998 | |
|---|---|---|
| Name: | hexadecafluoroheptane | |
| Description: | IUPAC names and InChI codes were generated with InstantJChem Original name was: perfluoroheptane | |
| Labels: | ||
| CAS: | 335-57-9 | |
| InChi Code: | InChI=1S/C7F16/c8-1(9,2(10,11)4(14,15)6(18,19)20)3(12,13)5(16,17)7(21,22)23 |
Properties
M16.logVP: Vapor pressure as log(VP) [log(mm Hg)]
| Value | Source or prediction |
|---|---|
| 1.883 |
experimental value |
| 1.2044 |
Tab2.Model_16: PFC vapor pressure (Training set) |
Links to External Resources
| Link | Resource description |
|---|---|
| DTXSID8052019 | US EPA CompTox Dashboard |