(E)-3,4,4,4-tetrafluoro-3-(1,1,2,2,3,3,3-heptafluoropropoxy)-1-iodobut-1-ene
Formula:C7H2OF11I
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(E)-3,4,4,4-tetrafluoro-3-(1,1,2,2,3,3,3-heptafluoropropoxy)-1-iodobut-1-ene is a drug-like molecule.
| MolName | (E)-3,4,4,4-tetrafluoro-3-(1,1,2,2,3,3,3-heptafluoropropoxy)-1-iodobut-1-ene |
| MolecularFormula | C7H2OF11I |
| Smiles | FC(C(OC(C(F)(F)F)(/C=C/I)F)(F)F)(C(F)(F)F)F |
| InChI | InChI=1S/C7H2F11IO/c8-3(1-2-19,5(11,12)13)20-7(17,18)4(9,10)6(14,15)16/h1-2H/t3-/m0/s1 |
| InChIK | PXYZPNZRASQXPV-VKHMYHEASA-N |
| TotalMolweight | 437.97 |
| Molweight | 437.97 |
| MonoisotopicMass | 437.897471 |
| CLogP | 4.9824 |
| CLogS | -4.751 |
| H Acceptors | 1 |
| TotalSurfaceArea | 198.18 |
| Relative PSA | 0.050459 |
| PolarSurfaceArea | 9.23 |
| Druglikeness | -60.938 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | |
| Shape Index | 0.45 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 13 |
| Electronegative Atoms | 13 |
| StereoCenters | 1 |
| Rotatable Bond | 6 |
| Sp3Atoms | 6 |
| Symmetricatoms | 6 |
| StereoCon | racemate |
Click to Load Molecule:
1 - (E)-3,4,4,4-tetrafluoro-3-(1,1,2,2,3,3,3-heptafluoropropoxy)-1-iodobut-1-ene | 2 - (E)-3,4,4,4-tetrafluoro-3-(1,1,2,2,3,3,3-heptafluoropropoxy)-1-iodobut-1-ene
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off