(Z)-2-chloro-1,1,1,4-tetrafluorobut-2-ene
Formula:C4H3ClF4
Mutagenic:low
Tumorigenic:low
Reproductive Effective:low
(Z)-2-chloro-1,1,1,4-tetrafluorobut-2-ene is a drug-like molecule.
| MolName | (Z)-2-chloro-1,1,1,4-tetrafluorobut-2-ene |
| MolecularFormula | C4H3ClF4 |
| Smiles | FC/C=C(/C(F)(F)F)\Cl |
| InChI | InChI=1S/C4H3ClF4/c5-3(1-2-6)4(7,8)9/h1H,2H2 |
| InChIK | USNKISPGPVQSDY-UHFFFAOYSA-N |
| TotalMolweight | 162.513 |
| Molweight | 162.513 |
| MonoisotopicMass | 161.985939 |
| CLogP | 2.3541 |
| CLogS | -2.802 |
| TotalSurfaceArea | 103.2 |
| Druglikeness | -7.8633 |
| Mutagenic | low |
| Tumorigenic | low |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 9 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - (Z)-2-chloro-1,1,1,4-tetrafluorobut-2-ene | 2 - (Z)-2-chloro-1,1,1,4-tetrafluorobut-2-ene
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