About dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane
dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane (PubChem CID 13268601) has the molecular formula C14H22OSi
and a molecular weight of 234.41 g/mol. Its IUPAC name is dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane.
Molecular Properties
| Compound Name | dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane |
| PubChem CID | 13268601 |
| Molecular Formula | C14H22OSi |
| Molecular Weight | 234.41 g/mol |
| Exact Mass | 234.14 |
| IUPAC Name | dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane |
| SMILES | C[Si](C)(CCc1ccccc1)C1CCCO1 |
| InChI | InChI=1S/C14H22OSi/c1-16(2,14-9-6-11-15-14)12-10-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12H2,1-2H3 |
| InChIKey | KHFWHVJPBYEBLN-UHFFFAOYSA-N |
| XLogP | 3.66 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 234.41 |
| LogP ≤ 5 | 3.66 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
|---|
Analyze dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane?
The IUPAC name of dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane (CID 13268601) is dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane.
What is the SMILES notation for dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane?
The canonical SMILES for dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane is C[Si](C)(CCc1ccccc1)C1CCCO1.
What is the InChIKey of dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane?
The InChIKey is KHFWHVJPBYEBLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22OSi/c1-16(2,14-9-6-11-15-14)12-10-13-7-4-3-5-8-13/h3-5,7-8,14H,6,9-12H2,1-2H3.
What are the key properties of dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane?
dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane has a molecular weight of 234.41 g/mol, XLogP of 3.66, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-(oxolan-2-yl)-(2-phenylethyl)silane is sourced from PubChem (CID 13268601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).