About 2-(1-prop-2-enoxybutyl)oxasilinane
2-(1-prop-2-enoxybutyl)oxasilinane (PubChem CID 173370568) has the molecular formula C11H22O2Si
and a molecular weight of 214.38 g/mol. Its IUPAC name is 2-(1-prop-2-enoxybutyl)oxasilinane.
Molecular Properties
| Compound Name | 2-(1-prop-2-enoxybutyl)oxasilinane |
| PubChem CID | 173370568 |
| Molecular Formula | C11H22O2Si |
| Molecular Weight | 214.38 g/mol |
| Exact Mass | 214.14 |
| IUPAC Name | 2-(1-prop-2-enoxybutyl)oxasilinane |
| SMILES | C=CCOC(CCC)[SiH]1CCCCO1 |
| InChI | InChI=1S/C11H22O2Si/c1-3-7-11(12-8-4-2)14-10-6-5-9-13-14/h4,11,14H,2-3,5-10H2,1H3 |
| InChIKey | XNLKCNYVLPUHMX-UHFFFAOYSA-N |
| XLogP | 2.43 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 214.38 |
| LogP ≤ 5 | 2.43 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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 2-(1-prop-2-enoxybutyl)oxasilinane?
The IUPAC name of 2-(1-prop-2-enoxybutyl)oxasilinane (CID 173370568) is 2-(1-prop-2-enoxybutyl)oxasilinane.
What is the SMILES notation for 2-(1-prop-2-enoxybutyl)oxasilinane?
The canonical SMILES for 2-(1-prop-2-enoxybutyl)oxasilinane is C=CCOC(CCC)[SiH]1CCCCO1.
What is the InChIKey of 2-(1-prop-2-enoxybutyl)oxasilinane?
The InChIKey is XNLKCNYVLPUHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2Si/c1-3-7-11(12-8-4-2)14-10-6-5-9-13-14/h4,11,14H,2-3,5-10H2,1H3.
What are the key properties of 2-(1-prop-2-enoxybutyl)oxasilinane?
2-(1-prop-2-enoxybutyl)oxasilinane has a molecular weight of 214.38 g/mol, XLogP of 2.43, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-prop-2-enoxybutyl)oxasilinane is sourced from PubChem (CID 173370568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).