About cyclohexylmethoxy-ethoxy-diphenylsilane
cyclohexylmethoxy-ethoxy-diphenylsilane (PubChem CID 91724609) has the molecular formula C21H28O2Si
and a molecular weight of 340.54 g/mol. Its IUPAC name is cyclohexylmethoxy-ethoxy-diphenylsilane.
Molecular Properties
| Compound Name | cyclohexylmethoxy-ethoxy-diphenylsilane |
| PubChem CID | 91724609 |
| Molecular Formula | C21H28O2Si |
| Molecular Weight | 340.54 g/mol |
| Exact Mass | 340.19 |
| IUPAC Name | cyclohexylmethoxy-ethoxy-diphenylsilane |
| SMILES | CCO[Si](OCC1CCCCC1)(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C21H28O2Si/c1-2-22-24(20-14-8-4-9-15-20,21-16-10-5-11-17-21)23-18-19-12-6-3-7-13-19/h4-5,8-11,14-17,19H,2-3,6-7,12-13,18H2,1H3 |
| InChIKey | XMRYPNYCFQFCBC-UHFFFAOYSA-N |
| XLogP | 3.88 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 340.54 |
| LogP ≤ 5 | 3.88 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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 cyclohexylmethoxy-ethoxy-diphenylsilane?
The IUPAC name of cyclohexylmethoxy-ethoxy-diphenylsilane (CID 91724609) is cyclohexylmethoxy-ethoxy-diphenylsilane.
What is the SMILES notation for cyclohexylmethoxy-ethoxy-diphenylsilane?
The canonical SMILES for cyclohexylmethoxy-ethoxy-diphenylsilane is CCO[Si](OCC1CCCCC1)(c1ccccc1)c1ccccc1.
What is the InChIKey of cyclohexylmethoxy-ethoxy-diphenylsilane?
The InChIKey is XMRYPNYCFQFCBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28O2Si/c1-2-22-24(20-14-8-4-9-15-20,21-16-10-5-11-17-21)23-18-19-12-6-3-7-13-19/h4-5,8-11,14-17,19H,2-3,6-7,12-13,18H2,1H3.
What are the key properties of cyclohexylmethoxy-ethoxy-diphenylsilane?
cyclohexylmethoxy-ethoxy-diphenylsilane has a molecular weight of 340.54 g/mol, XLogP of 3.88, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexylmethoxy-ethoxy-diphenylsilane is sourced from PubChem (CID 91724609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).