About 9-cyclopropylidenebicyclo[6.1.0]nonane
9-cyclopropylidenebicyclo[6.1.0]nonane (PubChem CID 15438127) has the molecular formula C12H18
and a molecular weight of 162.28 g/mol. Its IUPAC name is 9-cyclopropylidenebicyclo[6.1.0]nonane.
Molecular Properties
| Compound Name | 9-cyclopropylidenebicyclo[6.1.0]nonane |
| PubChem CID | 15438127 |
| Molecular Formula | C12H18 |
| Molecular Weight | 162.28 g/mol |
| Exact Mass | 162.14 |
| IUPAC Name | 9-cyclopropylidenebicyclo[6.1.0]nonane |
| SMILES | C1CCCC2C(=C3CC3)C2CC1 |
| InChI | InChI=1S/C12H18/c1-2-4-6-11-10(5-3-1)12(11)9-7-8-9/h10-11H,1-8H2 |
| InChIKey | VRKBFHCCPSYQGN-UHFFFAOYSA-N |
| XLogP | 3.68 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 162.28 |
| LogP ≤ 5 | 3.68 |
| 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 9-cyclopropylidenebicyclo[6.1.0]nonane?
The IUPAC name of 9-cyclopropylidenebicyclo[6.1.0]nonane (CID 15438127) is 9-cyclopropylidenebicyclo[6.1.0]nonane.
What is the SMILES notation for 9-cyclopropylidenebicyclo[6.1.0]nonane?
The canonical SMILES for 9-cyclopropylidenebicyclo[6.1.0]nonane is C1CCCC2C(=C3CC3)C2CC1.
What is the InChIKey of 9-cyclopropylidenebicyclo[6.1.0]nonane?
The InChIKey is VRKBFHCCPSYQGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18/c1-2-4-6-11-10(5-3-1)12(11)9-7-8-9/h10-11H,1-8H2.
What are the key properties of 9-cyclopropylidenebicyclo[6.1.0]nonane?
9-cyclopropylidenebicyclo[6.1.0]nonane has a molecular weight of 162.28 g/mol, XLogP of 3.68, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 9-cyclopropylidenebicyclo[6.1.0]nonane is sourced from PubChem (CID 15438127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).