About ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane
ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane (PubChem CID 554717) has the molecular formula C14H32OSi
and a molecular weight of 244.49 g/mol. Its IUPAC name is ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane.
Molecular Properties
| Compound Name | ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane |
| PubChem CID | 554717 |
| Molecular Formula | C14H32OSi |
| Molecular Weight | 244.49 g/mol |
| Exact Mass | 244.22 |
| IUPAC Name | ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane |
| SMILES | CCC(CC)CCC(CC)O[Si](C)(C)CC |
| InChI | InChI=1S/C14H32OSi/c1-7-13(8-2)11-12-14(9-3)15-16(5,6)10-4/h13-14H,7-12H2,1-6H3 |
| InChIKey | VJDBCUFEQMYNMO-UHFFFAOYSA-N |
| XLogP | 5.22 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 244.49 |
| LogP ≤ 5 | 5.22 |
| 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 ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane?
The IUPAC name of ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane (CID 554717) is ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane.
What is the SMILES notation for ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane?
The canonical SMILES for ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane is CCC(CC)CCC(CC)O[Si](C)(C)CC.
What is the InChIKey of ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane?
The InChIKey is VJDBCUFEQMYNMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32OSi/c1-7-13(8-2)11-12-14(9-3)15-16(5,6)10-4/h13-14H,7-12H2,1-6H3.
What are the key properties of ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane?
ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane has a molecular weight of 244.49 g/mol, XLogP of 5.22, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-(6-ethyloctan-3-yloxy)-dimethylsilane is sourced from PubChem (CID 554717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).