[(Z)-3-chloroprop-2-enyl]benzene
Formula:C9H9Cl
Mutagenic:low
Tumorigenic:low
Reproductive Effective:high
[(Z)-3-chloroprop-2-enyl]benzene is a drug-like molecule.
| MolName | [(Z)-3-chloroprop-2-enyl]benzene |
| MolecularFormula | C9H9Cl |
| Smiles | Cl/C=C\Cc1ccccc1 |
| InChI | InChI=1S/C9H9Cl/c10-8-4-7-9-5-2-1-3-6-9/h1-6,8H,7H2 |
| InChIK | JJTUJRVKTPSEFZ-UHFFFAOYSA-N |
| TotalMolweight | 152.623 |
| Molweight | 152.623 |
| MonoisotopicMass | 152.039277 |
| CLogP | 2.8113 |
| CLogS | -2.736 |
| TotalSurfaceArea | 128.94 |
| Druglikeness | -1.9718 |
| Mutagenic | low |
| Tumorigenic | low |
| Reproductive Effective | high |
| Irritant | low |
| Nasty Functions | |
| Shape Index | 0.8 |
| Fragments | 1 |
| Non HAtoms | 10 |
| NonCHAtoms | 1 |
| Electronegative Atoms | 1 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| StereoCon |
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