About 1-ethenyl-2-ethyl-9H-fluorene
1-ethenyl-2-ethyl-9H-fluorene (PubChem CID 158586423) has the molecular formula C17H16
and a molecular weight of 220.31 g/mol. Its IUPAC name is 1-ethenyl-2-ethyl-9H-fluorene.
Molecular Properties
| Compound Name | 1-ethenyl-2-ethyl-9H-fluorene |
| PubChem CID | 158586423 |
| Molecular Formula | C17H16 |
| Molecular Weight | 220.31 g/mol |
| Exact Mass | 220.13 |
| IUPAC Name | 1-ethenyl-2-ethyl-9H-fluorene |
| SMILES | C=Cc1c(CC)ccc2c1Cc1ccccc1-2 |
| InChI | InChI=1S/C17H16/c1-3-12-9-10-16-15-8-6-5-7-13(15)11-17(16)14(12)4-2/h4-10H,2-3,11H2,1H3 |
| InChIKey | HTWNQZIJTCJLFI-UHFFFAOYSA-N |
| XLogP | 4.46 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 220.31 |
| LogP ≤ 5 | 4.46 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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Frequently Asked Questions
What is the IUPAC name of 1-ethenyl-2-ethyl-9H-fluorene?
The IUPAC name of 1-ethenyl-2-ethyl-9H-fluorene (CID 158586423) is 1-ethenyl-2-ethyl-9H-fluorene.
What is the SMILES notation for 1-ethenyl-2-ethyl-9H-fluorene?
The canonical SMILES for 1-ethenyl-2-ethyl-9H-fluorene is C=Cc1c(CC)ccc2c1Cc1ccccc1-2.
What is the InChIKey of 1-ethenyl-2-ethyl-9H-fluorene?
The InChIKey is HTWNQZIJTCJLFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16/c1-3-12-9-10-16-15-8-6-5-7-13(15)11-17(16)14(12)4-2/h4-10H,2-3,11H2,1H3.
What are the key properties of 1-ethenyl-2-ethyl-9H-fluorene?
1-ethenyl-2-ethyl-9H-fluorene has a molecular weight of 220.31 g/mol, XLogP of 4.46, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2-ethyl-9H-fluorene is sourced from PubChem (CID 158586423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).