About triethyl(octacosyl)silane
triethyl(octacosyl)silane (PubChem CID 173084780) has the molecular formula C34H72Si
and a molecular weight of 509.04 g/mol. Its IUPAC name is triethyl(octacosyl)silane.
Molecular Properties
| Compound Name | triethyl(octacosyl)silane |
| PubChem CID | 173084780 |
| Molecular Formula | C34H72Si |
| Molecular Weight | 509.04 g/mol |
| Exact Mass | 508.54 |
| IUPAC Name | triethyl(octacosyl)silane |
| SMILES | CCCCCCCCCCCCCCCCCCCCCCCCCCCC[Si](CC)(CC)CC |
| InChI | InChI=1S/C34H72Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35(6-2,7-3)8-4/h5-34H2,1-4H3 |
| InChIKey | UTYHTYSFDOSMAX-UHFFFAOYSA-N |
| XLogP | 13.66 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 30 |
| Heavy Atoms | 35 |
| Complexity | — |
Lipinski Rule of Five
2 violations
| Rule | Value |
| MW ≤ 500 | 509.04 |
| LogP ≤ 5 | 13.66 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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 triethyl(octacosyl)silane?
The IUPAC name of triethyl(octacosyl)silane (CID 173084780) is triethyl(octacosyl)silane.
What is the SMILES notation for triethyl(octacosyl)silane?
The canonical SMILES for triethyl(octacosyl)silane is CCCCCCCCCCCCCCCCCCCCCCCCCCCC[Si](CC)(CC)CC.
What is the InChIKey of triethyl(octacosyl)silane?
The InChIKey is UTYHTYSFDOSMAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H72Si/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35(6-2,7-3)8-4/h5-34H2,1-4H3.
What are the key properties of triethyl(octacosyl)silane?
triethyl(octacosyl)silane has a molecular weight of 509.04 g/mol, XLogP of 13.66, 30 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(octacosyl)silane is sourced from PubChem (CID 173084780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).