About [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene
[(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene (PubChem CID 134934904) has the molecular formula C17H17F
and a molecular weight of 240.32 g/mol. Its IUPAC name is [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene.
Molecular Properties
| Compound Name | [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene |
| PubChem CID | 134934904 |
| Molecular Formula | C17H17F |
| Molecular Weight | 240.32 g/mol |
| Exact Mass | 240.13 |
| IUPAC Name | [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene |
| SMILES | FCC/C=C(\Cc1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C17H17F/c18-13-7-12-17(16-10-5-2-6-11-16)14-15-8-3-1-4-9-15/h1-6,8-12H,7,13-14H2/b17-12+ |
| InChIKey | SESRPYKHTIWOGK-SFQUDFHCSA-N |
| XLogP | 4.67 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 5 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 240.32 |
| LogP ≤ 5 | 4.67 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene?
The IUPAC name of [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene (CID 134934904) is [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene.
What is the SMILES notation for [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene?
The canonical SMILES for [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene is FCC/C=C(\Cc1ccccc1)c1ccccc1.
What is the InChIKey of [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene?
The InChIKey is SESRPYKHTIWOGK-SFQUDFHCSA-N. The full InChI is InChI=1S/C17H17F/c18-13-7-12-17(16-10-5-2-6-11-16)14-15-8-3-1-4-9-15/h1-6,8-12H,7,13-14H2/b17-12+.
What are the key properties of [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene?
[(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene has a molecular weight of 240.32 g/mol, XLogP of 4.67, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-5-fluoro-1-phenylpent-2-en-2-yl]benzene is sourced from PubChem (CID 134934904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).