(3E)-5,5,6,6,7,7,7-heptafluorohepta-1,3-diene
Formula:C7H5F7
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(3E)-5,5,6,6,7,7,7-heptafluorohepta-1,3-diene is a drug-like molecule.
| MolName | (3E)-5,5,6,6,7,7,7-heptafluorohepta-1,3-diene |
| MolecularFormula | C7H5F7 |
| Smiles | C=C/C=C/C(C(C(F)(F)F)(F)F)(F)F |
| InChI | InChI=1S/C7H5F7/c1-2-3-4-5(8,9)6(10,11)7(12,13)14/h2-4H,1H2 |
| InChIK | WGRVVKSLZCGFFX-UHFFFAOYSA-N |
| TotalMolweight | 222.103 |
| Molweight | 222.103 |
| MonoisotopicMass | 222.027946 |
| CLogP | 3.805 |
| CLogS | -3.681 |
| TotalSurfaceArea | 140.22 |
| Druglikeness | -71.381 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 14 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| StereoCon |
Click to Load Molecule:
1 - (3E)-5,5,6,6,7,7,7-heptafluorohepta-1,3-diene | 2 - (3E)-5,5,6,6,7,7,7-heptafluorohepta-1,3-diene
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off