About docosoxy(trimethyl)silane
docosoxy(trimethyl)silane (PubChem CID 529830) has the molecular formula C25H54OSi
and a molecular weight of 398.79 g/mol. Its IUPAC name is docosoxy(trimethyl)silane.
Molecular Properties
| Compound Name | docosoxy(trimethyl)silane |
| PubChem CID | 529830 |
| Molecular Formula | C25H54OSi |
| Molecular Weight | 398.79 g/mol |
| Exact Mass | 398.39 |
| IUPAC Name | docosoxy(trimethyl)silane |
| SMILES | CCCCCCCCCCCCCCCCCCCCCCO[Si](C)(C)C |
| InChI | InChI=1S/C25H54OSi/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(2,3)4/h5-25H2,1-4H3 |
| InChIKey | BTEWSNDTFDUGBB-UHFFFAOYSA-N |
| XLogP | 9.66 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 22 |
| Heavy Atoms | 27 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 398.79 |
| LogP ≤ 5 | 9.66 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of docosoxy(trimethyl)silane?
The IUPAC name of docosoxy(trimethyl)silane (CID 529830) is docosoxy(trimethyl)silane.
What is the SMILES notation for docosoxy(trimethyl)silane?
The canonical SMILES for docosoxy(trimethyl)silane is CCCCCCCCCCCCCCCCCCCCCCO[Si](C)(C)C.
What is the InChIKey of docosoxy(trimethyl)silane?
The InChIKey is BTEWSNDTFDUGBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H54OSi/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(2,3)4/h5-25H2,1-4H3.
What are the key properties of docosoxy(trimethyl)silane?
docosoxy(trimethyl)silane has a molecular weight of 398.79 g/mol, XLogP of 9.66, 22 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for docosoxy(trimethyl)silane is sourced from PubChem (CID 529830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).