About 1-(9H-fluoren-9-yl)-1-methylsiletane
1-(9H-fluoren-9-yl)-1-methylsiletane (PubChem CID 18512845) has the molecular formula C17H18Si
and a molecular weight of 250.42 g/mol. Its IUPAC name is 1-(9H-fluoren-9-yl)-1-methylsiletane.
Molecular Properties
| Compound Name | 1-(9H-fluoren-9-yl)-1-methylsiletane |
| PubChem CID | 18512845 |
| Molecular Formula | C17H18Si |
| Molecular Weight | 250.42 g/mol |
| Exact Mass | 250.12 |
| IUPAC Name | 1-(9H-fluoren-9-yl)-1-methylsiletane |
| SMILES | C[Si]1(C2c3ccccc3-c3ccccc32)CCC1 |
| InChI | InChI=1S/C17H18Si/c1-18(11-6-12-18)17-15-9-4-2-7-13(15)14-8-3-5-10-16(14)17/h2-5,7-10,17H,6,11-12H2,1H3 |
| InChIKey | AYLANMGFUVROMP-UHFFFAOYSA-N |
| XLogP | 4.82 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 250.42 |
| LogP ≤ 5 | 4.82 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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-(9H-fluoren-9-yl)-1-methylsiletane?
The IUPAC name of 1-(9H-fluoren-9-yl)-1-methylsiletane (CID 18512845) is 1-(9H-fluoren-9-yl)-1-methylsiletane.
What is the SMILES notation for 1-(9H-fluoren-9-yl)-1-methylsiletane?
The canonical SMILES for 1-(9H-fluoren-9-yl)-1-methylsiletane is C[Si]1(C2c3ccccc3-c3ccccc32)CCC1.
What is the InChIKey of 1-(9H-fluoren-9-yl)-1-methylsiletane?
The InChIKey is AYLANMGFUVROMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Si/c1-18(11-6-12-18)17-15-9-4-2-7-13(15)14-8-3-5-10-16(14)17/h2-5,7-10,17H,6,11-12H2,1H3.
What are the key properties of 1-(9H-fluoren-9-yl)-1-methylsiletane?
1-(9H-fluoren-9-yl)-1-methylsiletane has a molecular weight of 250.42 g/mol, XLogP of 4.82, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-fluoren-9-yl)-1-methylsiletane is sourced from PubChem (CID 18512845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).