About 11-[tert-butyl(dimethyl)silyl]undecan-1-ol
11-[tert-butyl(dimethyl)silyl]undecan-1-ol (PubChem CID 88610107) has the molecular formula C17H38OSi
and a molecular weight of 286.58 g/mol. Its IUPAC name is 11-[tert-butyl(dimethyl)silyl]undecan-1-ol.
Molecular Properties
| Compound Name | 11-[tert-butyl(dimethyl)silyl]undecan-1-ol |
| PubChem CID | 88610107 |
| Molecular Formula | C17H38OSi |
| Molecular Weight | 286.58 g/mol |
| Exact Mass | 286.27 |
| IUPAC Name | 11-[tert-butyl(dimethyl)silyl]undecan-1-ol |
| SMILES | CC(C)(C)[Si](C)(C)CCCCCCCCCCCO |
| InChI | InChI=1S/C17H38OSi/c1-17(2,3)19(4,5)16-14-12-10-8-6-7-9-11-13-15-18/h18H,6-16H2,1-5H3 |
| InChIKey | NZTKZRLDTPCDTB-UHFFFAOYSA-N |
| XLogP | 6.00 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 286.58 |
| LogP ≤ 5 | 6.00 |
| H-Bond Donors ≤ 5 | 1 |
| 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 11-[tert-butyl(dimethyl)silyl]undecan-1-ol?
The IUPAC name of 11-[tert-butyl(dimethyl)silyl]undecan-1-ol (CID 88610107) is 11-[tert-butyl(dimethyl)silyl]undecan-1-ol.
What is the SMILES notation for 11-[tert-butyl(dimethyl)silyl]undecan-1-ol?
The canonical SMILES for 11-[tert-butyl(dimethyl)silyl]undecan-1-ol is CC(C)(C)[Si](C)(C)CCCCCCCCCCCO.
What is the InChIKey of 11-[tert-butyl(dimethyl)silyl]undecan-1-ol?
The InChIKey is NZTKZRLDTPCDTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38OSi/c1-17(2,3)19(4,5)16-14-12-10-8-6-7-9-11-13-15-18/h18H,6-16H2,1-5H3.
What are the key properties of 11-[tert-butyl(dimethyl)silyl]undecan-1-ol?
11-[tert-butyl(dimethyl)silyl]undecan-1-ol has a molecular weight of 286.58 g/mol, XLogP of 6.00, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 11-[tert-butyl(dimethyl)silyl]undecan-1-ol is sourced from PubChem (CID 88610107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).