About diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane
diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane (PubChem CID 91730718) has the molecular formula C14H32O3Si
and a molecular weight of 276.49 g/mol. Its IUPAC name is diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane.
Molecular Properties
| Compound Name | diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane |
| PubChem CID | 91730718 |
| Molecular Formula | C14H32O3Si |
| Molecular Weight | 276.49 g/mol |
| Exact Mass | 276.21 |
| IUPAC Name | diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane |
| SMILES | CC[Si](CC)(OCC(C)C)OCC(C)CCOC |
| InChI | InChI=1S/C14H32O3Si/c1-7-18(8-2,16-11-13(3)4)17-12-14(5)9-10-15-6/h13-14H,7-12H2,1-6H3 |
| InChIKey | XODDXRNFDJXOJP-UHFFFAOYSA-N |
| XLogP | 3.83 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 276.49 |
| LogP ≤ 5 | 3.83 |
| 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 diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane?
The IUPAC name of diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane (CID 91730718) is diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane.
What is the SMILES notation for diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane?
The canonical SMILES for diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane is CC[Si](CC)(OCC(C)C)OCC(C)CCOC.
What is the InChIKey of diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane?
The InChIKey is XODDXRNFDJXOJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O3Si/c1-7-18(8-2,16-11-13(3)4)17-12-14(5)9-10-15-6/h13-14H,7-12H2,1-6H3.
What are the key properties of diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane?
diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane has a molecular weight of 276.49 g/mol, XLogP of 3.83, 11 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(4-methoxy-2-methylbutoxy)-(2-methylpropoxy)silane is sourced from PubChem (CID 91730718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).