About (E)-undec-4-ene
(E)-undec-4-ene (PubChem CID 5358315) has the molecular formula C11H22
and a molecular weight of 154.30 g/mol. Its IUPAC name is (E)-undec-4-ene.
Molecular Properties
| Compound Name | (E)-undec-4-ene |
| PubChem CID | 5358315 |
| Molecular Formula | C11H22 |
| Molecular Weight | 154.30 g/mol |
| Exact Mass | 154.17 |
| IUPAC Name | (E)-undec-4-ene |
| SMILES | CCC/C=C/CCCCCC |
| InChI | InChI=1S/C11H22/c1-3-5-7-9-11-10-8-6-4-2/h7,9H,3-6,8,10-11H2,1-2H3/b9-7+ |
| InChIKey | JABYJIQOLGWMQW-VQHVLOKHSA-N |
| XLogP | 4.31 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 7 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 154.30 |
| LogP ≤ 5 | 4.31 |
| 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': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (E)-undec-4-ene?
The IUPAC name of (E)-undec-4-ene (CID 5358315) is (E)-undec-4-ene.
What is the SMILES notation for (E)-undec-4-ene?
The canonical SMILES for (E)-undec-4-ene is CCC/C=C/CCCCCC.
What is the InChIKey of (E)-undec-4-ene?
The InChIKey is JABYJIQOLGWMQW-VQHVLOKHSA-N. The full InChI is InChI=1S/C11H22/c1-3-5-7-9-11-10-8-6-4-2/h7,9H,3-6,8,10-11H2,1-2H3/b9-7+.
What are the key properties of (E)-undec-4-ene?
(E)-undec-4-ene has a molecular weight of 154.30 g/mol, XLogP of 4.31, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-undec-4-ene is sourced from PubChem (CID 5358315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).