About tributyl(decoxy)silane
tributyl(decoxy)silane (PubChem CID 523467) has the molecular formula C22H48OSi
and a molecular weight of 356.71 g/mol. Its IUPAC name is tributyl(decoxy)silane.
Molecular Properties
| Compound Name | tributyl(decoxy)silane |
| PubChem CID | 523467 |
| Molecular Formula | C22H48OSi |
| Molecular Weight | 356.71 g/mol |
| Exact Mass | 356.35 |
| IUPAC Name | tributyl(decoxy)silane |
| SMILES | CCCCCCCCCCO[Si](CCCC)(CCCC)CCCC |
| InChI | InChI=1S/C22H48OSi/c1-5-9-13-14-15-16-17-18-19-23-24(20-10-6-2,21-11-7-3)22-12-8-4/h5-22H2,1-4H3 |
| InChIKey | YXNCBZRZBPTNQZ-UHFFFAOYSA-N |
| XLogP | 8.49 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 19 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 356.71 |
| LogP ≤ 5 | 8.49 |
| 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 tributyl(decoxy)silane?
The IUPAC name of tributyl(decoxy)silane (CID 523467) is tributyl(decoxy)silane.
What is the SMILES notation for tributyl(decoxy)silane?
The canonical SMILES for tributyl(decoxy)silane is CCCCCCCCCCO[Si](CCCC)(CCCC)CCCC.
What is the InChIKey of tributyl(decoxy)silane?
The InChIKey is YXNCBZRZBPTNQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H48OSi/c1-5-9-13-14-15-16-17-18-19-23-24(20-10-6-2,21-11-7-3)22-12-8-4/h5-22H2,1-4H3.
What are the key properties of tributyl(decoxy)silane?
tributyl(decoxy)silane has a molecular weight of 356.71 g/mol, XLogP of 8.49, 19 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(decoxy)silane is sourced from PubChem (CID 523467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).