About fluoro-(fluoromethyl)-methyl-phenylsilane
fluoro-(fluoromethyl)-methyl-phenylsilane (PubChem CID 155657984) has the molecular formula C8H10F2Si
and a molecular weight of 172.25 g/mol. Its IUPAC name is fluoro-(fluoromethyl)-methyl-phenylsilane.
Molecular Properties
| Compound Name | fluoro-(fluoromethyl)-methyl-phenylsilane |
| PubChem CID | 155657984 |
| Molecular Formula | C8H10F2Si |
| Molecular Weight | 172.25 g/mol |
| Exact Mass | 172.05 |
| IUPAC Name | fluoro-(fluoromethyl)-methyl-phenylsilane |
| SMILES | C[Si](F)(CF)c1ccccc1 |
| InChI | InChI=1S/C8H10F2Si/c1-11(10,7-9)8-5-3-2-4-6-8/h2-6H,7H2,1H3 |
| InChIKey | YVGTXUJJKCGUCS-UHFFFAOYSA-N |
| XLogP | 1.95 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 172.25 |
| LogP ≤ 5 | 1.95 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of fluoro-(fluoromethyl)-methyl-phenylsilane?
The IUPAC name of fluoro-(fluoromethyl)-methyl-phenylsilane (CID 155657984) is fluoro-(fluoromethyl)-methyl-phenylsilane.
What is the SMILES notation for fluoro-(fluoromethyl)-methyl-phenylsilane?
The canonical SMILES for fluoro-(fluoromethyl)-methyl-phenylsilane is C[Si](F)(CF)c1ccccc1.
What is the InChIKey of fluoro-(fluoromethyl)-methyl-phenylsilane?
The InChIKey is YVGTXUJJKCGUCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2Si/c1-11(10,7-9)8-5-3-2-4-6-8/h2-6H,7H2,1H3.
What are the key properties of fluoro-(fluoromethyl)-methyl-phenylsilane?
fluoro-(fluoromethyl)-methyl-phenylsilane has a molecular weight of 172.25 g/mol, XLogP of 1.95, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for fluoro-(fluoromethyl)-methyl-phenylsilane is sourced from PubChem (CID 155657984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).