About 1-phenylpropyl(dipropoxy)silane
1-phenylpropyl(dipropoxy)silane (PubChem CID 173016700) has the molecular formula C15H26O2Si
and a molecular weight of 266.46 g/mol. Its IUPAC name is 1-phenylpropyl(dipropoxy)silane.
Molecular Properties
| Compound Name | 1-phenylpropyl(dipropoxy)silane |
| PubChem CID | 173016700 |
| Molecular Formula | C15H26O2Si |
| Molecular Weight | 266.46 g/mol |
| Exact Mass | 266.17 |
| IUPAC Name | 1-phenylpropyl(dipropoxy)silane |
| SMILES | CCCO[SiH](OCCC)C(CC)c1ccccc1 |
| InChI | InChI=1S/C15H26O2Si/c1-4-12-16-18(17-13-5-2)15(6-3)14-10-8-7-9-11-14/h7-11,15,18H,4-6,12-13H2,1-3H3 |
| InChIKey | XZFVAWXPIHUNEA-UHFFFAOYSA-N |
| XLogP | 3.79 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 266.46 |
| LogP ≤ 5 | 3.79 |
| 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-phenylpropyl(dipropoxy)silane?
The IUPAC name of 1-phenylpropyl(dipropoxy)silane (CID 173016700) is 1-phenylpropyl(dipropoxy)silane.
What is the SMILES notation for 1-phenylpropyl(dipropoxy)silane?
The canonical SMILES for 1-phenylpropyl(dipropoxy)silane is CCCO[SiH](OCCC)C(CC)c1ccccc1.
What is the InChIKey of 1-phenylpropyl(dipropoxy)silane?
The InChIKey is XZFVAWXPIHUNEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O2Si/c1-4-12-16-18(17-13-5-2)15(6-3)14-10-8-7-9-11-14/h7-11,15,18H,4-6,12-13H2,1-3H3.
What are the key properties of 1-phenylpropyl(dipropoxy)silane?
1-phenylpropyl(dipropoxy)silane has a molecular weight of 266.46 g/mol, XLogP of 3.79, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenylpropyl(dipropoxy)silane is sourced from PubChem (CID 173016700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).