About ethoxy-diethyl-phenoxysilane
ethoxy-diethyl-phenoxysilane (PubChem CID 15146062) has the molecular formula C12H20O2Si
and a molecular weight of 224.38 g/mol. Its IUPAC name is ethoxy-diethyl-phenoxysilane.
Molecular Properties
| Compound Name | ethoxy-diethyl-phenoxysilane |
| PubChem CID | 15146062 |
| Molecular Formula | C12H20O2Si |
| Molecular Weight | 224.38 g/mol |
| Exact Mass | 224.12 |
| IUPAC Name | ethoxy-diethyl-phenoxysilane |
| SMILES | CCO[Si](CC)(CC)Oc1ccccc1 |
| InChI | InChI=1S/C12H20O2Si/c1-4-13-15(5-2,6-3)14-12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3 |
| InChIKey | LNFZSMPMUAZZIU-UHFFFAOYSA-N |
| XLogP | 3.58 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 224.38 |
| LogP ≤ 5 | 3.58 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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 ethoxy-diethyl-phenoxysilane?
The IUPAC name of ethoxy-diethyl-phenoxysilane (CID 15146062) is ethoxy-diethyl-phenoxysilane.
What is the SMILES notation for ethoxy-diethyl-phenoxysilane?
The canonical SMILES for ethoxy-diethyl-phenoxysilane is CCO[Si](CC)(CC)Oc1ccccc1.
What is the InChIKey of ethoxy-diethyl-phenoxysilane?
The InChIKey is LNFZSMPMUAZZIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O2Si/c1-4-13-15(5-2,6-3)14-12-10-8-7-9-11-12/h7-11H,4-6H2,1-3H3.
What are the key properties of ethoxy-diethyl-phenoxysilane?
ethoxy-diethyl-phenoxysilane has a molecular weight of 224.38 g/mol, XLogP of 3.58, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-diethyl-phenoxysilane is sourced from PubChem (CID 15146062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).