About 1-phenylethyl-di(propan-2-yloxy)silane
1-phenylethyl-di(propan-2-yloxy)silane (PubChem CID 173017191) has the molecular formula C14H24O2Si
and a molecular weight of 252.43 g/mol. Its IUPAC name is 1-phenylethyl-di(propan-2-yloxy)silane.
Molecular Properties
| Compound Name | 1-phenylethyl-di(propan-2-yloxy)silane |
| PubChem CID | 173017191 |
| Molecular Formula | C14H24O2Si |
| Molecular Weight | 252.43 g/mol |
| Exact Mass | 252.15 |
| IUPAC Name | 1-phenylethyl-di(propan-2-yloxy)silane |
| SMILES | CC(C)O[SiH](OC(C)C)C(C)c1ccccc1 |
| InChI | InChI=1S/C14H24O2Si/c1-11(2)15-17(16-12(3)4)13(5)14-9-7-6-8-10-14/h6-13,17H,1-5H3 |
| InChIKey | GRCMRHAAYVXRLK-UHFFFAOYSA-N |
| XLogP | 3.40 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 252.43 |
| LogP ≤ 5 | 3.40 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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 1-phenylethyl-di(propan-2-yloxy)silane?
The IUPAC name of 1-phenylethyl-di(propan-2-yloxy)silane (CID 173017191) is 1-phenylethyl-di(propan-2-yloxy)silane.
What is the SMILES notation for 1-phenylethyl-di(propan-2-yloxy)silane?
The canonical SMILES for 1-phenylethyl-di(propan-2-yloxy)silane is CC(C)O[SiH](OC(C)C)C(C)c1ccccc1.
What is the InChIKey of 1-phenylethyl-di(propan-2-yloxy)silane?
The InChIKey is GRCMRHAAYVXRLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O2Si/c1-11(2)15-17(16-12(3)4)13(5)14-9-7-6-8-10-14/h6-13,17H,1-5H3.
What are the key properties of 1-phenylethyl-di(propan-2-yloxy)silane?
1-phenylethyl-di(propan-2-yloxy)silane has a molecular weight of 252.43 g/mol, XLogP of 3.40, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenylethyl-di(propan-2-yloxy)silane is sourced from PubChem (CID 173017191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).