About 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane
3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane (PubChem CID 11623558) has the molecular formula C17H34O2Si
and a molecular weight of 298.54 g/mol. Its IUPAC name is 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane.
Molecular Properties
| Compound Name | 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane |
| PubChem CID | 11623558 |
| Molecular Formula | C17H34O2Si |
| Molecular Weight | 298.54 g/mol |
| Exact Mass | 298.23 |
| IUPAC Name | 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane |
| SMILES | C=CCC(CCO[Si](C(C)C)(C(C)C)C(C)C)OC=C |
| InChI | InChI=1S/C17H34O2Si/c1-9-11-17(18-10-2)12-13-19-20(14(3)4,15(5)6)16(7)8/h9-10,14-17H,1-2,11-13H2,3-8H3 |
| InChIKey | ZUHXOGAWJPAQRM-UHFFFAOYSA-N |
| XLogP | 5.67 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 298.54 |
| LogP ≤ 5 | 5.67 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'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 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane?
The IUPAC name of 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane (CID 11623558) is 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane.
What is the SMILES notation for 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane?
The canonical SMILES for 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane is C=CCC(CCO[Si](C(C)C)(C(C)C)C(C)C)OC=C.
What is the InChIKey of 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane?
The InChIKey is ZUHXOGAWJPAQRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O2Si/c1-9-11-17(18-10-2)12-13-19-20(14(3)4,15(5)6)16(7)8/h9-10,14-17H,1-2,11-13H2,3-8H3.
What are the key properties of 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane?
3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane has a molecular weight of 298.54 g/mol, XLogP of 5.67, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenoxyhex-5-enoxy-tri(propan-2-yl)silane is sourced from PubChem (CID 11623558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).