About ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane
ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane (PubChem CID 153321945) has the molecular formula C26H58O2Si2
and a molecular weight of 458.92 g/mol. Its IUPAC name is ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane.
Molecular Properties
| Compound Name | ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane |
| PubChem CID | 153321945 |
| Molecular Formula | C26H58O2Si2 |
| Molecular Weight | 458.92 g/mol |
| Exact Mass | 458.40 |
| IUPAC Name | ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane |
| SMILES | CCO[Si](C)(C)CCCCCCCCCCCCCCCCCC[Si](C)(C)OCC |
| InChI | InChI=1S/C26H58O2Si2/c1-7-27-29(3,4)25-23-21-19-17-15-13-11-9-10-12-14-16-18-20-22-24-26-30(5,6)28-8-2/h7-26H2,1-6H3 |
| InChIKey | MMDJYIJIVIKATN-UHFFFAOYSA-N |
| XLogP | 9.71 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 23 |
| Heavy Atoms | 30 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 458.92 |
| LogP ≤ 5 | 9.71 |
| 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 ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane 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 ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane?
The IUPAC name of ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane (CID 153321945) is ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane.
What is the SMILES notation for ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane?
The canonical SMILES for ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane is CCO[Si](C)(C)CCCCCCCCCCCCCCCCCC[Si](C)(C)OCC.
What is the InChIKey of ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane?
The InChIKey is MMDJYIJIVIKATN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H58O2Si2/c1-7-27-29(3,4)25-23-21-19-17-15-13-11-9-10-12-14-16-18-20-22-24-26-30(5,6)28-8-2/h7-26H2,1-6H3.
What are the key properties of ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane?
ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane has a molecular weight of 458.92 g/mol, XLogP of 9.71, 23 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxy-[18-[ethoxy(dimethyl)silyl]octadecyl]-dimethylsilane is sourced from PubChem (CID 153321945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).