About 2-phenylethenyl(propyl)silane
2-phenylethenyl(propyl)silane (PubChem CID 123611778) has the molecular formula C11H16Si
and a molecular weight of 176.34 g/mol. Its IUPAC name is 2-phenylethenyl(propyl)silane.
Molecular Properties
| Compound Name | 2-phenylethenyl(propyl)silane |
| PubChem CID | 123611778 |
| Molecular Formula | C11H16Si |
| Molecular Weight | 176.34 g/mol |
| Exact Mass | 176.10 |
| IUPAC Name | 2-phenylethenyl(propyl)silane |
| SMILES | CCC[SiH2]C=Cc1ccccc1 |
| InChI | InChI=1S/C11H16Si/c1-2-9-12-10-8-11-6-4-3-5-7-11/h3-8,10H,2,9,12H2,1H3 |
| InChIKey | DNTAJBJYFYDUIO-UHFFFAOYSA-N |
| XLogP | 2.65 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 4 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 176.34 |
| LogP ≤ 5 | 2.65 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-phenylethenyl(propyl)silane?
The IUPAC name of 2-phenylethenyl(propyl)silane (CID 123611778) is 2-phenylethenyl(propyl)silane.
What is the SMILES notation for 2-phenylethenyl(propyl)silane?
The canonical SMILES for 2-phenylethenyl(propyl)silane is CCC[SiH2]C=Cc1ccccc1.
What is the InChIKey of 2-phenylethenyl(propyl)silane?
The InChIKey is DNTAJBJYFYDUIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16Si/c1-2-9-12-10-8-11-6-4-3-5-7-11/h3-8,10H,2,9,12H2,1H3.
What are the key properties of 2-phenylethenyl(propyl)silane?
2-phenylethenyl(propyl)silane has a molecular weight of 176.34 g/mol, XLogP of 2.65, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylethenyl(propyl)silane is sourced from PubChem (CID 123611778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).