| MolName | (E)-6,6,7,7,8,8,9,9-octafluoro-1-(2-hydroxyphenyl)non-1-ene-3,5-dione |
| MolecularFormula | C15H10O3F8 |
| Smiles | Oc1c(/C=C/C(CC(C(C(C(C(F)F)(F)F)(F)F)(F)F)=O)=O)cccc1 |
| InChI | InChI=1S/C15H10F8O3/c16-12(17)14(20,21)15(22,23)13(18,19)11(26)7-9(24)6-5-8-3-1-2-4-10(8)25/h1-6,12,25H,7H2 |
| InChIK | NISFLHZQQUEFHO-UHFFFAOYSA-N |
| TotalMolweight | 390.225 |
| Molweight | 390.225 |
| MonoisotopicMass | 390.050219 |
| CLogP | 3.5565 |
| CLogS | -4.967 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 249.9 |
| Relative PSA | 0.15678 |
| PolarSurfaceArea | 54.37 |
| Druglikeness | -76.141 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.53846 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 11 |
| Electronegative Atoms | 11 |
| Rotatable Bond | 8 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 6 |
| Symmetricatoms | 4 |
| StereoCon |
Click to Load Molecule:
1 - (E)-6,6,7,7,8,8,9,9-octafluoro-1-(2-hydroxyphenyl)non-1-ene-3,5-dione | 2 - (E)-6,6,7,7,8,8,9,9-octafluoro-1-(2-hydroxyphenyl)non-1-ene-3,5-dione