About 3-trimethylsilyloxyprop-1-enylideneiron(1+)
3-trimethylsilyloxyprop-1-enylideneiron(1+) (PubChem CID 11050885) has the molecular formula C6H12FeOSi+
and a molecular weight of 184.09 g/mol. Its IUPAC name is 3-trimethylsilyloxyprop-1-enylideneiron(1+).
Molecular Properties
| Compound Name | 3-trimethylsilyloxyprop-1-enylideneiron(1+) |
| PubChem CID | 11050885 |
| Molecular Formula | C6H12FeOSi+ |
| Molecular Weight | 184.09 g/mol |
| Exact Mass | 184.00 |
| IUPAC Name | 3-trimethylsilyloxyprop-1-enylideneiron(1+) |
| SMILES | C[Si](C)(C)OCC=C=[Fe+] |
| InChI | InChI=1S/C6H12OSi.Fe/c1-5-6-7-8(2,3)4;/h5H,6H2,2-4H3;/q;+1 |
| InChIKey | QTRDTDUVQWKQGM-UHFFFAOYSA-N |
| XLogP | 1.34 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 184.09 |
| LogP ≤ 5 | 1.34 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 3-trimethylsilyloxyprop-1-enylideneiron(1+)?
The IUPAC name of 3-trimethylsilyloxyprop-1-enylideneiron(1+) (CID 11050885) is 3-trimethylsilyloxyprop-1-enylideneiron(1+).
What is the SMILES notation for 3-trimethylsilyloxyprop-1-enylideneiron(1+)?
The canonical SMILES for 3-trimethylsilyloxyprop-1-enylideneiron(1+) is C[Si](C)(C)OCC=C=[Fe+].
What is the InChIKey of 3-trimethylsilyloxyprop-1-enylideneiron(1+)?
The InChIKey is QTRDTDUVQWKQGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12OSi.Fe/c1-5-6-7-8(2,3)4;/h5H,6H2,2-4H3;/q;+1.
What are the key properties of 3-trimethylsilyloxyprop-1-enylideneiron(1+)?
3-trimethylsilyloxyprop-1-enylideneiron(1+) has a molecular weight of 184.09 g/mol, XLogP of 1.34, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-trimethylsilyloxyprop-1-enylideneiron(1+) is sourced from PubChem (CID 11050885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).