About [(E)-non-3-en-3-yl]selanylbenzene
[(E)-non-3-en-3-yl]selanylbenzene (PubChem CID 102123205) has the molecular formula C15H22Se
and a molecular weight of 281.30 g/mol. Its IUPAC name is [(E)-non-3-en-3-yl]selanylbenzene.
Molecular Properties
| Compound Name | [(E)-non-3-en-3-yl]selanylbenzene |
| PubChem CID | 102123205 |
| Molecular Formula | C15H22Se |
| Molecular Weight | 281.30 g/mol |
| Exact Mass | 282.09 |
| IUPAC Name | [(E)-non-3-en-3-yl]selanylbenzene |
| SMILES | CCCCC/C=C(\CC)[Se]c1ccccc1 |
| InChI | InChI=1S/C15H22Se/c1-3-5-6-8-11-14(4-2)16-15-12-9-7-10-13-15/h7,9-13H,3-6,8H2,1-2H3/b14-11+ |
| InChIKey | QLDISEXZUFRRBE-SDNWHVSQSA-N |
| XLogP | 3.89 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 7 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 281.30 |
| LogP ≤ 5 | 3.89 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [(E)-non-3-en-3-yl]selanylbenzene?
The IUPAC name of [(E)-non-3-en-3-yl]selanylbenzene (CID 102123205) is [(E)-non-3-en-3-yl]selanylbenzene.
What is the SMILES notation for [(E)-non-3-en-3-yl]selanylbenzene?
The canonical SMILES for [(E)-non-3-en-3-yl]selanylbenzene is CCCCC/C=C(\CC)[Se]c1ccccc1.
What is the InChIKey of [(E)-non-3-en-3-yl]selanylbenzene?
The InChIKey is QLDISEXZUFRRBE-SDNWHVSQSA-N. The full InChI is InChI=1S/C15H22Se/c1-3-5-6-8-11-14(4-2)16-15-12-9-7-10-13-15/h7,9-13H,3-6,8H2,1-2H3/b14-11+.
What are the key properties of [(E)-non-3-en-3-yl]selanylbenzene?
[(E)-non-3-en-3-yl]selanylbenzene has a molecular weight of 281.30 g/mol, XLogP of 3.89, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-non-3-en-3-yl]selanylbenzene is sourced from PubChem (CID 102123205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).