About ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane
ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane (PubChem CID 66774383) has the molecular formula C16H28O2Si
and a molecular weight of 280.48 g/mol. Its IUPAC name is ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane.
Molecular Properties
| Compound Name | ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane |
| PubChem CID | 66774383 |
| Molecular Formula | C16H28O2Si |
| Molecular Weight | 280.48 g/mol |
| Exact Mass | 280.19 |
| IUPAC Name | ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane |
| SMILES | CC[Si](OC(C)(C)C)(OC(C)(C)C)c1ccccc1 |
| InChI | InChI=1S/C16H28O2Si/c1-8-19(17-15(2,3)4,18-16(5,6)7)14-12-10-9-11-13-14/h9-13H,8H2,1-7H3 |
| InChIKey | RTVKTUCNLAHPES-UHFFFAOYSA-N |
| XLogP | 3.99 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 280.48 |
| LogP ≤ 5 | 3.99 |
| 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 ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane?
The IUPAC name of ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane (CID 66774383) is ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane.
What is the SMILES notation for ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane?
The canonical SMILES for ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane is CC[Si](OC(C)(C)C)(OC(C)(C)C)c1ccccc1.
What is the InChIKey of ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane?
The InChIKey is RTVKTUCNLAHPES-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28O2Si/c1-8-19(17-15(2,3)4,18-16(5,6)7)14-12-10-9-11-13-14/h9-13H,8H2,1-7H3.
What are the key properties of ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane?
ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane has a molecular weight of 280.48 g/mol, XLogP of 3.99, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-bis[(2-methylpropan-2-yl)oxy]-phenylsilane is sourced from PubChem (CID 66774383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).