About triethyl(octadecoxy)silane
triethyl(octadecoxy)silane (PubChem CID 523472) has the molecular formula C24H52OSi
and a molecular weight of 384.77 g/mol. Its IUPAC name is triethyl(octadecoxy)silane.
Molecular Properties
| Compound Name | triethyl(octadecoxy)silane |
| PubChem CID | 523472 |
| Molecular Formula | C24H52OSi |
| Molecular Weight | 384.77 g/mol |
| Exact Mass | 384.38 |
| IUPAC Name | triethyl(octadecoxy)silane |
| SMILES | CCCCCCCCCCCCCCCCCCO[Si](CC)(CC)CC |
| InChI | InChI=1S/C24H52OSi/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(6-2,7-3)8-4/h5-24H2,1-4H3 |
| InChIKey | GONKWHYRECIOHM-UHFFFAOYSA-N |
| XLogP | 9.27 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 21 |
| Heavy Atoms | 26 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 384.77 |
| LogP ≤ 5 | 9.27 |
| 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 triethyl(octadecoxy)silane?
The IUPAC name of triethyl(octadecoxy)silane (CID 523472) is triethyl(octadecoxy)silane.
What is the SMILES notation for triethyl(octadecoxy)silane?
The canonical SMILES for triethyl(octadecoxy)silane is CCCCCCCCCCCCCCCCCCO[Si](CC)(CC)CC.
What is the InChIKey of triethyl(octadecoxy)silane?
The InChIKey is GONKWHYRECIOHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52OSi/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26(6-2,7-3)8-4/h5-24H2,1-4H3.
What are the key properties of triethyl(octadecoxy)silane?
triethyl(octadecoxy)silane has a molecular weight of 384.77 g/mol, XLogP of 9.27, 21 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl(octadecoxy)silane is sourced from PubChem (CID 523472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).