dichloro-[(E)-1-chloro-2-phenylethenyl]phosphane
Formula:C8H6Cl3P
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
dichloro-[(E)-1-chloro-2-phenylethenyl]phosphane is a drug-like molecule.
| MolName | dichloro-[(E)-1-chloro-2-phenylethenyl]phosphane |
| MolecularFormula | C8H6Cl3P |
| Smiles | Cl/C(/P(Cl)Cl)=C/c1ccccc1 |
| InChI | InChI=1S/C8H6Cl3P/c9-8(12(10)11)6-7-4-2-1-3-5-7/h1-6H |
| InChIK | QPMLPZMGYUDJCF-UHFFFAOYSA-N |
| TotalMolweight | 239.469 |
| Molweight | 239.469 |
| MonoisotopicMass | 237.927268 |
| CLogP | 3.2018 |
| CLogS | -4.54 |
| TotalSurfaceArea | 150.98 |
| PolarSurfaceArea | 13.59 |
| Druglikeness | -13.12 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | Cl,Br,I on N,O,P,S,Se,I |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 12 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 2 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| Symmetricatoms | 3 |
| StereoCon |
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1 - dichloro-[(E)-1-chloro-2-phenylethenyl]phosphane | 2 - dichloro-[(E)-1-chloro-2-phenylethenyl]phosphane
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