About but-3-en-2-yloxy-diethoxy-propan-2-ylsilane
but-3-en-2-yloxy-diethoxy-propan-2-ylsilane (PubChem CID 169153478) has the molecular formula C11H24O3Si
and a molecular weight of 232.40 g/mol. Its IUPAC name is but-3-en-2-yloxy-diethoxy-propan-2-ylsilane.
Molecular Properties
| Compound Name | but-3-en-2-yloxy-diethoxy-propan-2-ylsilane |
| PubChem CID | 169153478 |
| Molecular Formula | C11H24O3Si |
| Molecular Weight | 232.40 g/mol |
| Exact Mass | 232.15 |
| IUPAC Name | but-3-en-2-yloxy-diethoxy-propan-2-ylsilane |
| SMILES | C=CC(C)O[Si](OCC)(OCC)C(C)C |
| InChI | InChI=1S/C11H24O3Si/c1-7-11(6)14-15(10(4)5,12-8-2)13-9-3/h7,10-11H,1,8-9H2,2-6H3 |
| InChIKey | BEFKOUDOZNFZFU-UHFFFAOYSA-N |
| XLogP | 3.00 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 232.40 |
| LogP ≤ 5 | 3.00 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of but-3-en-2-yloxy-diethoxy-propan-2-ylsilane?
The IUPAC name of but-3-en-2-yloxy-diethoxy-propan-2-ylsilane (CID 169153478) is but-3-en-2-yloxy-diethoxy-propan-2-ylsilane.
What is the SMILES notation for but-3-en-2-yloxy-diethoxy-propan-2-ylsilane?
The canonical SMILES for but-3-en-2-yloxy-diethoxy-propan-2-ylsilane is C=CC(C)O[Si](OCC)(OCC)C(C)C.
What is the InChIKey of but-3-en-2-yloxy-diethoxy-propan-2-ylsilane?
The InChIKey is BEFKOUDOZNFZFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3Si/c1-7-11(6)14-15(10(4)5,12-8-2)13-9-3/h7,10-11H,1,8-9H2,2-6H3.
What are the key properties of but-3-en-2-yloxy-diethoxy-propan-2-ylsilane?
but-3-en-2-yloxy-diethoxy-propan-2-ylsilane has a molecular weight of 232.40 g/mol, XLogP of 3.00, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for but-3-en-2-yloxy-diethoxy-propan-2-ylsilane is sourced from PubChem (CID 169153478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).