About butyl-dimethoxy-tetradecylsilane
butyl-dimethoxy-tetradecylsilane (PubChem CID 139614249) has the molecular formula C20H44O2Si
and a molecular weight of 344.66 g/mol. Its IUPAC name is butyl-dimethoxy-tetradecylsilane.
Molecular Properties
| Compound Name | butyl-dimethoxy-tetradecylsilane |
| PubChem CID | 139614249 |
| Molecular Formula | C20H44O2Si |
| Molecular Weight | 344.66 g/mol |
| Exact Mass | 344.31 |
| IUPAC Name | butyl-dimethoxy-tetradecylsilane |
| SMILES | CCCCCCCCCCCCCC[Si](CCCC)(OC)OC |
| InChI | InChI=1S/C20H44O2Si/c1-5-7-9-10-11-12-13-14-15-16-17-18-20-23(21-3,22-4)19-8-6-2/h5-20H2,1-4H3 |
| InChIKey | TYSMEEVMNMMPHP-UHFFFAOYSA-N |
| XLogP | 7.22 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 344.66 |
| LogP ≤ 5 | 7.22 |
| 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'} |
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Frequently Asked Questions
What is the IUPAC name of butyl-dimethoxy-tetradecylsilane?
The IUPAC name of butyl-dimethoxy-tetradecylsilane (CID 139614249) is butyl-dimethoxy-tetradecylsilane.
What is the SMILES notation for butyl-dimethoxy-tetradecylsilane?
The canonical SMILES for butyl-dimethoxy-tetradecylsilane is CCCCCCCCCCCCCC[Si](CCCC)(OC)OC.
What is the InChIKey of butyl-dimethoxy-tetradecylsilane?
The InChIKey is TYSMEEVMNMMPHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H44O2Si/c1-5-7-9-10-11-12-13-14-15-16-17-18-20-23(21-3,22-4)19-8-6-2/h5-20H2,1-4H3.
What are the key properties of butyl-dimethoxy-tetradecylsilane?
butyl-dimethoxy-tetradecylsilane has a molecular weight of 344.66 g/mol, XLogP of 7.22, 18 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-dimethoxy-tetradecylsilane is sourced from PubChem (CID 139614249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).