About phenyl(prop-2-enoxy)silane
phenyl(prop-2-enoxy)silane (PubChem CID 123615662) has the molecular formula C9H12OSi
and a molecular weight of 164.28 g/mol. Its IUPAC name is phenyl(prop-2-enoxy)silane.
Molecular Properties
| Compound Name | phenyl(prop-2-enoxy)silane |
| PubChem CID | 123615662 |
| Molecular Formula | C9H12OSi |
| Molecular Weight | 164.28 g/mol |
| Exact Mass | 164.07 |
| IUPAC Name | phenyl(prop-2-enoxy)silane |
| SMILES | C=CCO[SiH2]c1ccccc1 |
| InChI | InChI=1S/C9H12OSi/c1-2-8-10-11-9-6-4-3-5-7-9/h2-7H,1,8,11H2 |
| InChIKey | FJDAKQBKGIKLQK-UHFFFAOYSA-N |
| XLogP | 0.60 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 164.28 |
| LogP ≤ 5 | 0.60 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 phenyl(prop-2-enoxy)silane?
The IUPAC name of phenyl(prop-2-enoxy)silane (CID 123615662) is phenyl(prop-2-enoxy)silane.
What is the SMILES notation for phenyl(prop-2-enoxy)silane?
The canonical SMILES for phenyl(prop-2-enoxy)silane is C=CCO[SiH2]c1ccccc1.
What is the InChIKey of phenyl(prop-2-enoxy)silane?
The InChIKey is FJDAKQBKGIKLQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12OSi/c1-2-8-10-11-9-6-4-3-5-7-9/h2-7H,1,8,11H2.
What are the key properties of phenyl(prop-2-enoxy)silane?
phenyl(prop-2-enoxy)silane has a molecular weight of 164.28 g/mol, XLogP of 0.60, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(prop-2-enoxy)silane is sourced from PubChem (CID 123615662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).