About phenoxy-phenyl-(trifluoromethyl)silane
phenoxy-phenyl-(trifluoromethyl)silane (PubChem CID 123142407) has the molecular formula C13H11F3OSi
and a molecular weight of 268.31 g/mol. Its IUPAC name is phenoxy-phenyl-(trifluoromethyl)silane.
Molecular Properties
| Compound Name | phenoxy-phenyl-(trifluoromethyl)silane |
| PubChem CID | 123142407 |
| Molecular Formula | C13H11F3OSi |
| Molecular Weight | 268.31 g/mol |
| Exact Mass | 268.05 |
| IUPAC Name | phenoxy-phenyl-(trifluoromethyl)silane |
| SMILES | FC(F)(F)[SiH](Oc1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C13H11F3OSi/c14-13(15,16)18(12-9-5-2-6-10-12)17-11-7-3-1-4-8-11/h1-10,18H |
| InChIKey | VNDBLBFQQZZFAX-UHFFFAOYSA-N |
| XLogP | 2.80 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 268.31 |
| LogP ≤ 5 | 2.80 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of phenoxy-phenyl-(trifluoromethyl)silane?
The IUPAC name of phenoxy-phenyl-(trifluoromethyl)silane (CID 123142407) is phenoxy-phenyl-(trifluoromethyl)silane.
What is the SMILES notation for phenoxy-phenyl-(trifluoromethyl)silane?
The canonical SMILES for phenoxy-phenyl-(trifluoromethyl)silane is FC(F)(F)[SiH](Oc1ccccc1)c1ccccc1.
What is the InChIKey of phenoxy-phenyl-(trifluoromethyl)silane?
The InChIKey is VNDBLBFQQZZFAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11F3OSi/c14-13(15,16)18(12-9-5-2-6-10-12)17-11-7-3-1-4-8-11/h1-10,18H.
What are the key properties of phenoxy-phenyl-(trifluoromethyl)silane?
phenoxy-phenyl-(trifluoromethyl)silane has a molecular weight of 268.31 g/mol, XLogP of 2.80, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenoxy-phenyl-(trifluoromethyl)silane is sourced from PubChem (CID 123142407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).