About diethyl(dioctoxy)silane
diethyl(dioctoxy)silane (PubChem CID 23342511) has the molecular formula C20H44O2Si
and a molecular weight of 344.66 g/mol. Its IUPAC name is diethyl(dioctoxy)silane.
Molecular Properties
| Compound Name | diethyl(dioctoxy)silane |
| PubChem CID | 23342511 |
| Molecular Formula | C20H44O2Si |
| Molecular Weight | 344.66 g/mol |
| Exact Mass | 344.31 |
| IUPAC Name | diethyl(dioctoxy)silane |
| SMILES | CCCCCCCCO[Si](CC)(CC)OCCCCCCCC |
| InChI | InChI=1S/C20H44O2Si/c1-5-9-11-13-15-17-19-21-23(7-3,8-4)22-20-18-16-14-12-10-6-2/h5-20H2,1-4H3 |
| InChIKey | UVNWYQVDJRRQKJ-UHFFFAOYSA-N |
| XLogP | 7.22 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 344.66 |
| LogP ≤ 5 | 7.22 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze diethyl(dioctoxy)silane with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of diethyl(dioctoxy)silane?
The IUPAC name of diethyl(dioctoxy)silane (CID 23342511) is diethyl(dioctoxy)silane.
What is the SMILES notation for diethyl(dioctoxy)silane?
The canonical SMILES for diethyl(dioctoxy)silane is CCCCCCCCO[Si](CC)(CC)OCCCCCCCC.
What is the InChIKey of diethyl(dioctoxy)silane?
The InChIKey is UVNWYQVDJRRQKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H44O2Si/c1-5-9-11-13-15-17-19-21-23(7-3,8-4)22-20-18-16-14-12-10-6-2/h5-20H2,1-4H3.
What are the key properties of diethyl(dioctoxy)silane?
diethyl(dioctoxy)silane has a molecular weight of 344.66 g/mol, XLogP of 7.22, 18 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl(dioctoxy)silane is sourced from PubChem (CID 23342511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).