About 1-ethoxyethoxy-dimethyl-phenylsilane
1-ethoxyethoxy-dimethyl-phenylsilane (PubChem CID 121010756) has the molecular formula C12H20O2Si
and a molecular weight of 224.38 g/mol. Its IUPAC name is 1-ethoxyethoxy-dimethyl-phenylsilane.
Molecular Properties
| Compound Name | 1-ethoxyethoxy-dimethyl-phenylsilane |
| PubChem CID | 121010756 |
| Molecular Formula | C12H20O2Si |
| Molecular Weight | 224.38 g/mol |
| Exact Mass | 224.12 |
| IUPAC Name | 1-ethoxyethoxy-dimethyl-phenylsilane |
| SMILES | CCOC(C)O[Si](C)(C)c1ccccc1 |
| InChI | InChI=1S/C12H20O2Si/c1-5-13-11(2)14-15(3,4)12-9-7-6-8-10-12/h6-11H,5H2,1-4H3 |
| InChIKey | HMRGGAWXIDRHFY-UHFFFAOYSA-N |
| XLogP | 2.50 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 224.38 |
| LogP ≤ 5 | 2.50 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-ethoxyethoxy-dimethyl-phenylsilane?
The IUPAC name of 1-ethoxyethoxy-dimethyl-phenylsilane (CID 121010756) is 1-ethoxyethoxy-dimethyl-phenylsilane.
What is the SMILES notation for 1-ethoxyethoxy-dimethyl-phenylsilane?
The canonical SMILES for 1-ethoxyethoxy-dimethyl-phenylsilane is CCOC(C)O[Si](C)(C)c1ccccc1.
What is the InChIKey of 1-ethoxyethoxy-dimethyl-phenylsilane?
The InChIKey is HMRGGAWXIDRHFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20O2Si/c1-5-13-11(2)14-15(3,4)12-9-7-6-8-10-12/h6-11H,5H2,1-4H3.
What are the key properties of 1-ethoxyethoxy-dimethyl-phenylsilane?
1-ethoxyethoxy-dimethyl-phenylsilane has a molecular weight of 224.38 g/mol, XLogP of 2.50, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxyethoxy-dimethyl-phenylsilane is sourced from PubChem (CID 121010756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).