About trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane
trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane (PubChem CID 101261790) has the molecular formula C18H30OSi
and a molecular weight of 290.52 g/mol. Its IUPAC name is trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane.
Molecular Properties
| Compound Name | trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane |
| PubChem CID | 101261790 |
| Molecular Formula | C18H30OSi |
| Molecular Weight | 290.52 g/mol |
| Exact Mass | 290.21 |
| IUPAC Name | trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane |
| SMILES | CCCCCCC/C=C/c1ccc(O[Si](C)(C)C)cc1 |
| InChI | InChI=1S/C18H30OSi/c1-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)19-20(2,3)4/h11-16H,5-10H2,1-4H3/b12-11+ |
| InChIKey | MMGJAJBCCKTQHJ-VAWYXSNFSA-N |
| XLogP | 6.27 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 290.52 |
| LogP ≤ 5 | 6.27 |
| 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'} |
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Frequently Asked Questions
What is the IUPAC name of trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane?
The IUPAC name of trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane (CID 101261790) is trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane.
What is the SMILES notation for trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane?
The canonical SMILES for trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane is CCCCCCC/C=C/c1ccc(O[Si](C)(C)C)cc1.
What is the InChIKey of trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane?
The InChIKey is MMGJAJBCCKTQHJ-VAWYXSNFSA-N. The full InChI is InChI=1S/C18H30OSi/c1-5-6-7-8-9-10-11-12-17-13-15-18(16-14-17)19-20(2,3)4/h11-16H,5-10H2,1-4H3/b12-11+.
What are the key properties of trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane?
trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane has a molecular weight of 290.52 g/mol, XLogP of 6.27, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[4-[(E)-non-1-enyl]phenoxy]silane is sourced from PubChem (CID 101261790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).