About (E)-6-methylidenenon-4-ene
(E)-6-methylidenenon-4-ene (PubChem CID 14364497) has the molecular formula C10H18
and a molecular weight of 138.25 g/mol. Its IUPAC name is (E)-6-methylidenenon-4-ene.
Molecular Properties
| Compound Name | (E)-6-methylidenenon-4-ene |
| PubChem CID | 14364497 |
| Molecular Formula | C10H18 |
| Molecular Weight | 138.25 g/mol |
| Exact Mass | 138.14 |
| IUPAC Name | (E)-6-methylidenenon-4-ene |
| SMILES | C=C(/C=C/CCC)CCC |
| InChI | InChI=1S/C10H18/c1-4-6-7-9-10(3)8-5-2/h7,9H,3-6,8H2,1-2H3/b9-7+ |
| InChIKey | OFIKWRPXSNTQKK-VQHVLOKHSA-N |
| XLogP | 3.70 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 5 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 138.25 |
| LogP ≤ 5 | 3.70 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'polyene', 'substructure': 'N/A'} |
|---|
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Frequently Asked Questions
What is the IUPAC name of (E)-6-methylidenenon-4-ene?
The IUPAC name of (E)-6-methylidenenon-4-ene (CID 14364497) is (E)-6-methylidenenon-4-ene.
What is the SMILES notation for (E)-6-methylidenenon-4-ene?
The canonical SMILES for (E)-6-methylidenenon-4-ene is C=C(/C=C/CCC)CCC.
What is the InChIKey of (E)-6-methylidenenon-4-ene?
The InChIKey is OFIKWRPXSNTQKK-VQHVLOKHSA-N. The full InChI is InChI=1S/C10H18/c1-4-6-7-9-10(3)8-5-2/h7,9H,3-6,8H2,1-2H3/b9-7+.
What are the key properties of (E)-6-methylidenenon-4-ene?
(E)-6-methylidenenon-4-ene has a molecular weight of 138.25 g/mol, XLogP of 3.70, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-6-methylidenenon-4-ene is sourced from PubChem (CID 14364497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).