About (5R)-5-ethenyl-3,3-difluorooxane
(5R)-5-ethenyl-3,3-difluorooxane (PubChem CID 166486816) has the molecular formula C7H10F2O
and a molecular weight of 148.15 g/mol. Its IUPAC name is (5R)-5-ethenyl-3,3-difluorooxane.
Molecular Properties
| Compound Name | (5R)-5-ethenyl-3,3-difluorooxane |
| PubChem CID | 166486816 |
| Molecular Formula | C7H10F2O |
| Molecular Weight | 148.15 g/mol |
| Exact Mass | 148.07 |
| IUPAC Name | (5R)-5-ethenyl-3,3-difluorooxane |
| SMILES | C=C[C@@H]1COCC(F)(F)C1 |
| InChI | InChI=1S/C7H10F2O/c1-2-6-3-7(8,9)5-10-4-6/h2,6H,1,3-5H2/t6-/m0/s1 |
| InChIKey | NOZXKBIJOJEXDN-LURJTMIESA-N |
| XLogP | 1.84 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 148.15 |
| LogP ≤ 5 | 1.84 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (5R)-5-ethenyl-3,3-difluorooxane?
The IUPAC name of (5R)-5-ethenyl-3,3-difluorooxane (CID 166486816) is (5R)-5-ethenyl-3,3-difluorooxane.
What is the SMILES notation for (5R)-5-ethenyl-3,3-difluorooxane?
The canonical SMILES for (5R)-5-ethenyl-3,3-difluorooxane is C=C[C@@H]1COCC(F)(F)C1.
What is the InChIKey of (5R)-5-ethenyl-3,3-difluorooxane?
The InChIKey is NOZXKBIJOJEXDN-LURJTMIESA-N. The full InChI is InChI=1S/C7H10F2O/c1-2-6-3-7(8,9)5-10-4-6/h2,6H,1,3-5H2/t6-/m0/s1.
What are the key properties of (5R)-5-ethenyl-3,3-difluorooxane?
(5R)-5-ethenyl-3,3-difluorooxane has a molecular weight of 148.15 g/mol, XLogP of 1.84, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-ethenyl-3,3-difluorooxane is sourced from PubChem (CID 166486816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).