About methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane
methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane (PubChem CID 159525052) has the molecular formula C16H26O3Si
and a molecular weight of 294.47 g/mol. Its IUPAC name is methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane.
Molecular Properties
| Compound Name | methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane |
| PubChem CID | 159525052 |
| Molecular Formula | C16H26O3Si |
| Molecular Weight | 294.47 g/mol |
| Exact Mass | 294.17 |
| IUPAC Name | methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane |
| SMILES | CC(C)O[Si](C)(OC(C)(C)C1COC1)c1ccccc1 |
| InChI | InChI=1S/C16H26O3Si/c1-13(2)18-20(5,15-9-7-6-8-10-15)19-16(3,4)14-11-17-12-14/h6-10,13-14H,11-12H2,1-5H3 |
| InChIKey | MCGYQHIMUBWKSA-UHFFFAOYSA-N |
| XLogP | 2.83 |
| TPSA | 27.69 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 294.47 |
| LogP ≤ 5 | 2.83 |
| 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 methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane?
The IUPAC name of methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane (CID 159525052) is methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane.
What is the SMILES notation for methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane?
The canonical SMILES for methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane is CC(C)O[Si](C)(OC(C)(C)C1COC1)c1ccccc1.
What is the InChIKey of methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane?
The InChIKey is MCGYQHIMUBWKSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26O3Si/c1-13(2)18-20(5,15-9-7-6-8-10-15)19-16(3,4)14-11-17-12-14/h6-10,13-14H,11-12H2,1-5H3.
What are the key properties of methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane?
methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane has a molecular weight of 294.47 g/mol, XLogP of 2.83, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[2-(oxetan-3-yl)propan-2-yloxy]-phenyl-propan-2-yloxysilane is sourced from PubChem (CID 159525052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).