About 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane
2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane (PubChem CID 152525917) has the molecular formula C18H21ClOSi
and a molecular weight of 316.90 g/mol. Its IUPAC name is 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane.
Molecular Properties
| Compound Name | 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane |
| PubChem CID | 152525917 |
| Molecular Formula | C18H21ClOSi |
| Molecular Weight | 316.90 g/mol |
| Exact Mass | 316.11 |
| IUPAC Name | 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane |
| SMILES | C[Si](C)(C)CCOc1ccc2c(c1Cl)Cc1ccccc1-2 |
| InChI | InChI=1S/C18H21ClOSi/c1-21(2,3)11-10-20-17-9-8-15-14-7-5-4-6-13(14)12-16(15)18(17)19/h4-9H,10-12H2,1-3H3 |
| InChIKey | YIMYDDZONYFEDP-UHFFFAOYSA-N |
| XLogP | 5.63 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 316.90 |
| LogP ≤ 5 | 5.63 |
| 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 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane?
The IUPAC name of 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane (CID 152525917) is 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane.
What is the SMILES notation for 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane?
The canonical SMILES for 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane is C[Si](C)(C)CCOc1ccc2c(c1Cl)Cc1ccccc1-2.
What is the InChIKey of 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane?
The InChIKey is YIMYDDZONYFEDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21ClOSi/c1-21(2,3)11-10-20-17-9-8-15-14-7-5-4-6-13(14)12-16(15)18(17)19/h4-9H,10-12H2,1-3H3.
What are the key properties of 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane?
2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane has a molecular weight of 316.90 g/mol, XLogP of 5.63, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-chloro-9H-fluoren-2-yl)oxy]ethyl-trimethylsilane is sourced from PubChem (CID 152525917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).