About 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane
6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane (PubChem CID 90172578) has the molecular formula C15H25FOSi
and a molecular weight of 268.45 g/mol. Its IUPAC name is 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane.
Molecular Properties
| Compound Name | 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane |
| PubChem CID | 90172578 |
| Molecular Formula | C15H25FOSi |
| Molecular Weight | 268.45 g/mol |
| Exact Mass | 268.17 |
| IUPAC Name | 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane |
| SMILES | CO[Si](C)(C)CCCCCCc1cccc(F)c1 |
| InChI | InChI=1S/C15H25FOSi/c1-17-18(2,3)12-7-5-4-6-9-14-10-8-11-15(16)13-14/h8,10-11,13H,4-7,9,12H2,1-3H3 |
| InChIKey | ZGUVSHNCQTXDKE-UHFFFAOYSA-N |
| XLogP | 4.78 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 268.45 |
| LogP ≤ 5 | 4.78 |
| 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 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane?
The IUPAC name of 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane (CID 90172578) is 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane.
What is the SMILES notation for 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane?
The canonical SMILES for 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane is CO[Si](C)(C)CCCCCCc1cccc(F)c1.
What is the InChIKey of 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane?
The InChIKey is ZGUVSHNCQTXDKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25FOSi/c1-17-18(2,3)12-7-5-4-6-9-14-10-8-11-15(16)13-14/h8,10-11,13H,4-7,9,12H2,1-3H3.
What are the key properties of 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane?
6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane has a molecular weight of 268.45 g/mol, XLogP of 4.78, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluorophenyl)hexyl-methoxy-dimethylsilane is sourced from PubChem (CID 90172578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).