About 2-cyclohexylethyl(triethoxy)silane
2-cyclohexylethyl(triethoxy)silane (PubChem CID 21439246) has the molecular formula C14H30O3Si
and a molecular weight of 274.48 g/mol. Its IUPAC name is 2-cyclohexylethyl(triethoxy)silane.
Molecular Properties
| Compound Name | 2-cyclohexylethyl(triethoxy)silane |
| PubChem CID | 21439246 |
| Molecular Formula | C14H30O3Si |
| Molecular Weight | 274.48 g/mol |
| Exact Mass | 274.20 |
| IUPAC Name | 2-cyclohexylethyl(triethoxy)silane |
| SMILES | CCO[Si](CCC1CCCCC1)(OCC)OCC |
| InChI | InChI=1S/C14H30O3Si/c1-4-15-18(16-5-2,17-6-3)13-12-14-10-8-7-9-11-14/h14H,4-13H2,1-3H3 |
| InChIKey | ZQUCFSJTZVIWRB-UHFFFAOYSA-N |
| XLogP | 4.01 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 274.48 |
| LogP ≤ 5 | 4.01 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-cyclohexylethyl(triethoxy)silane?
The IUPAC name of 2-cyclohexylethyl(triethoxy)silane (CID 21439246) is 2-cyclohexylethyl(triethoxy)silane.
What is the SMILES notation for 2-cyclohexylethyl(triethoxy)silane?
The canonical SMILES for 2-cyclohexylethyl(triethoxy)silane is CCO[Si](CCC1CCCCC1)(OCC)OCC.
What is the InChIKey of 2-cyclohexylethyl(triethoxy)silane?
The InChIKey is ZQUCFSJTZVIWRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O3Si/c1-4-15-18(16-5-2,17-6-3)13-12-14-10-8-7-9-11-14/h14H,4-13H2,1-3H3.
What are the key properties of 2-cyclohexylethyl(triethoxy)silane?
2-cyclohexylethyl(triethoxy)silane has a molecular weight of 274.48 g/mol, XLogP of 4.01, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylethyl(triethoxy)silane is sourced from PubChem (CID 21439246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).