About 8-methylnon-3-ene
8-methylnon-3-ene (PubChem CID 54424784) has the molecular formula C10H20
and a molecular weight of 140.27 g/mol. Its IUPAC name is 8-methylnon-3-ene.
Molecular Properties
| Compound Name | 8-methylnon-3-ene |
| PubChem CID | 54424784 |
| Molecular Formula | C10H20 |
| Molecular Weight | 140.27 g/mol |
| Exact Mass | 140.16 |
| IUPAC Name | 8-methylnon-3-ene |
| SMILES | CCC=CCCCC(C)C |
| InChI | InChI=1S/C10H20/c1-4-5-6-7-8-9-10(2)3/h5-6,10H,4,7-9H2,1-3H3 |
| InChIKey | MWTCCUBOEJQUIB-UHFFFAOYSA-N |
| XLogP | 3.78 |
| 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 | 140.27 |
| LogP ≤ 5 | 3.78 |
| 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 8-methylnon-3-ene?
The IUPAC name of 8-methylnon-3-ene (CID 54424784) is 8-methylnon-3-ene.
What is the SMILES notation for 8-methylnon-3-ene?
The canonical SMILES for 8-methylnon-3-ene is CCC=CCCCC(C)C.
What is the InChIKey of 8-methylnon-3-ene?
The InChIKey is MWTCCUBOEJQUIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20/c1-4-5-6-7-8-9-10(2)3/h5-6,10H,4,7-9H2,1-3H3.
What are the key properties of 8-methylnon-3-ene?
8-methylnon-3-ene has a molecular weight of 140.27 g/mol, XLogP of 3.78, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methylnon-3-ene is sourced from PubChem (CID 54424784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).