About 11-silyloxysilylundecanoic acid
11-silyloxysilylundecanoic acid (PubChem CID 123166420) has the molecular formula C11H26O3Si2
and a molecular weight of 262.50 g/mol. Its IUPAC name is 11-silyloxysilylundecanoic acid.
Molecular Properties
| Compound Name | 11-silyloxysilylundecanoic acid |
| PubChem CID | 123166420 |
| Molecular Formula | C11H26O3Si2 |
| Molecular Weight | 262.50 g/mol |
| Exact Mass | 262.14 |
| IUPAC Name | 11-silyloxysilylundecanoic acid |
| SMILES | O=C(O)CCCCCCCCCC[SiH2]O[SiH3] |
| InChI | InChI=1S/C11H26O3Si2/c12-11(13)9-7-5-3-1-2-4-6-8-10-16-14-15/h1-10,16H2,15H3,(H,12,13) |
| InChIKey | ZNFSUQXFODDJDW-UHFFFAOYSA-N |
| XLogP | 1.38 |
| TPSA | 46.53 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 262.50 |
| LogP ≤ 5 | 1.38 |
| H-Bond Donors ≤ 5 | 1 |
| 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'} |
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Frequently Asked Questions
What is the IUPAC name of 11-silyloxysilylundecanoic acid?
The IUPAC name of 11-silyloxysilylundecanoic acid (CID 123166420) is 11-silyloxysilylundecanoic acid.
What is the SMILES notation for 11-silyloxysilylundecanoic acid?
The canonical SMILES for 11-silyloxysilylundecanoic acid is O=C(O)CCCCCCCCCC[SiH2]O[SiH3].
What is the InChIKey of 11-silyloxysilylundecanoic acid?
The InChIKey is ZNFSUQXFODDJDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26O3Si2/c12-11(13)9-7-5-3-1-2-4-6-8-10-16-14-15/h1-10,16H2,15H3,(H,12,13).
What are the key properties of 11-silyloxysilylundecanoic acid?
11-silyloxysilylundecanoic acid has a molecular weight of 262.50 g/mol, XLogP of 1.38, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-silyloxysilylundecanoic acid is sourced from PubChem (CID 123166420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).