| MolName | (Z)-3-(2,3,4,5,6-pentafluorophenyl)-2-pyridin-2-ylprop-2-enenitrile |
| MolecularFormula | C14H5N2F5 |
| Smiles | N#C/C(/c1ncccc1)=C\c(c(F)c(c(F)c1F)F)c1F |
| InChI | InChI=1S/C14H5F5N2/c15-10-8(11(16)13(18)14(19)12(10)17)5-7(6-20)9-3-1-2-4-21-9/h1-5H |
| InChIK | NUVGBOQBGHISPF-UHFFFAOYSA-N |
| TotalMolweight | 296.198 |
| Molweight | 296.198 |
| MonoisotopicMass | 296.037288 |
| CLogP | 2.8897 |
| CLogS | -4.428 |
| H Acceptors | 2 |
| TotalSurfaceArea | 209.95 |
| Relative PSA | 0.11684 |
| PolarSurfaceArea | 36.68 |
| Druglikeness | -6.4198 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | polyhalo aromatic ring |
| Shape Index | 0.52381 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (Z)-3-(2,3,4,5,6-pentafluorophenyl)-2-pyridin-2-ylprop-2-enenitrile | 2 - (Z)-3-(2,3,4,5,6-pentafluorophenyl)-2-pyridin-2-ylprop-2-enenitrile