About 7-methylidenedec-1-ene
7-methylidenedec-1-ene (PubChem CID 123417470) has the molecular formula C11H20
and a molecular weight of 152.28 g/mol. Its IUPAC name is 7-methylidenedec-1-ene.
Molecular Properties
| Compound Name | 7-methylidenedec-1-ene |
| PubChem CID | 123417470 |
| Molecular Formula | C11H20 |
| Molecular Weight | 152.28 g/mol |
| Exact Mass | 152.16 |
| IUPAC Name | 7-methylidenedec-1-ene |
| SMILES | C=CCCCCC(=C)CCC |
| InChI | InChI=1S/C11H20/c1-4-6-7-8-10-11(3)9-5-2/h4H,1,3,5-10H2,2H3 |
| InChIKey | HFTFUQUBJRMFGG-UHFFFAOYSA-N |
| XLogP | 4.09 |
| 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 | 152.28 |
| LogP ≤ 5 | 4.09 |
| 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'} |
|---|
Analyze 7-methylidenedec-1-ene with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 7-methylidenedec-1-ene?
The IUPAC name of 7-methylidenedec-1-ene (CID 123417470) is 7-methylidenedec-1-ene.
What is the SMILES notation for 7-methylidenedec-1-ene?
The canonical SMILES for 7-methylidenedec-1-ene is C=CCCCCC(=C)CCC.
What is the InChIKey of 7-methylidenedec-1-ene?
The InChIKey is HFTFUQUBJRMFGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20/c1-4-6-7-8-10-11(3)9-5-2/h4H,1,3,5-10H2,2H3.
What are the key properties of 7-methylidenedec-1-ene?
7-methylidenedec-1-ene has a molecular weight of 152.28 g/mol, XLogP of 4.09, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylidenedec-1-ene is sourced from PubChem (CID 123417470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).