About 5,6-dipropyldec-1-ene
5,6-dipropyldec-1-ene (PubChem CID 123363407) has the molecular formula C16H32
and a molecular weight of 224.43 g/mol. Its IUPAC name is 5,6-dipropyldec-1-ene.
Molecular Properties
| Compound Name | 5,6-dipropyldec-1-ene |
| PubChem CID | 123363407 |
| Molecular Formula | C16H32 |
| Molecular Weight | 224.43 g/mol |
| Exact Mass | 224.25 |
| IUPAC Name | 5,6-dipropyldec-1-ene |
| SMILES | C=CCCC(CCC)C(CCC)CCCC |
| InChI | InChI=1S/C16H32/c1-5-9-13-15(11-7-3)16(12-8-4)14-10-6-2/h5,15-16H,1,6-14H2,2-4H3 |
| InChIKey | NBJRLLGQRVJNEO-UHFFFAOYSA-N |
| XLogP | 5.98 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 11 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 224.43 |
| LogP ≤ 5 | 5.98 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 5,6-dipropyldec-1-ene?
The IUPAC name of 5,6-dipropyldec-1-ene (CID 123363407) is 5,6-dipropyldec-1-ene.
What is the SMILES notation for 5,6-dipropyldec-1-ene?
The canonical SMILES for 5,6-dipropyldec-1-ene is C=CCCC(CCC)C(CCC)CCCC.
What is the InChIKey of 5,6-dipropyldec-1-ene?
The InChIKey is NBJRLLGQRVJNEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32/c1-5-9-13-15(11-7-3)16(12-8-4)14-10-6-2/h5,15-16H,1,6-14H2,2-4H3.
What are the key properties of 5,6-dipropyldec-1-ene?
5,6-dipropyldec-1-ene has a molecular weight of 224.43 g/mol, XLogP of 5.98, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dipropyldec-1-ene is sourced from PubChem (CID 123363407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).