About 3,3-difluoropentyl(trimethyl)silane
3,3-difluoropentyl(trimethyl)silane (PubChem CID 18344472) has the molecular formula C8H18F2Si
and a molecular weight of 180.31 g/mol. Its IUPAC name is 3,3-difluoropentyl(trimethyl)silane.
Molecular Properties
| Compound Name | 3,3-difluoropentyl(trimethyl)silane |
| PubChem CID | 18344472 |
| Molecular Formula | C8H18F2Si |
| Molecular Weight | 180.31 g/mol |
| Exact Mass | 180.11 |
| IUPAC Name | 3,3-difluoropentyl(trimethyl)silane |
| SMILES | CCC(F)(F)CC[Si](C)(C)C |
| InChI | InChI=1S/C8H18F2Si/c1-5-8(9,10)6-7-11(2,3)4/h5-7H2,1-4H3 |
| InChIKey | QNLSRHQTMHBLKR-UHFFFAOYSA-N |
| XLogP | 3.76 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 4 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 180.31 |
| LogP ≤ 5 | 3.76 |
| 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 3,3-difluoropentyl(trimethyl)silane?
The IUPAC name of 3,3-difluoropentyl(trimethyl)silane (CID 18344472) is 3,3-difluoropentyl(trimethyl)silane.
What is the SMILES notation for 3,3-difluoropentyl(trimethyl)silane?
The canonical SMILES for 3,3-difluoropentyl(trimethyl)silane is CCC(F)(F)CC[Si](C)(C)C.
What is the InChIKey of 3,3-difluoropentyl(trimethyl)silane?
The InChIKey is QNLSRHQTMHBLKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18F2Si/c1-5-8(9,10)6-7-11(2,3)4/h5-7H2,1-4H3.
What are the key properties of 3,3-difluoropentyl(trimethyl)silane?
3,3-difluoropentyl(trimethyl)silane has a molecular weight of 180.31 g/mol, XLogP of 3.76, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoropentyl(trimethyl)silane is sourced from PubChem (CID 18344472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).