About 7-cyclopropylidenebicyclo[4.1.0]heptane
7-cyclopropylidenebicyclo[4.1.0]heptane (PubChem CID 134900897) has the molecular formula C10H14
and a molecular weight of 134.22 g/mol. Its IUPAC name is 7-cyclopropylidenebicyclo[4.1.0]heptane.
Molecular Properties
| Compound Name | 7-cyclopropylidenebicyclo[4.1.0]heptane |
| PubChem CID | 134900897 |
| Molecular Formula | C10H14 |
| Molecular Weight | 134.22 g/mol |
| Exact Mass | 134.11 |
| IUPAC Name | 7-cyclopropylidenebicyclo[4.1.0]heptane |
| SMILES | C1CCC2C(=C3CC3)C2C1 |
| InChI | InChI=1S/C10H14/c1-2-4-9-8(3-1)10(9)7-5-6-7/h8-9H,1-6H2 |
| InChIKey | OPLIWGSBCPYNMV-UHFFFAOYSA-N |
| XLogP | 2.90 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 134.22 |
| LogP ≤ 5 | 2.90 |
| 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 7-cyclopropylidenebicyclo[4.1.0]heptane?
The IUPAC name of 7-cyclopropylidenebicyclo[4.1.0]heptane (CID 134900897) is 7-cyclopropylidenebicyclo[4.1.0]heptane.
What is the SMILES notation for 7-cyclopropylidenebicyclo[4.1.0]heptane?
The canonical SMILES for 7-cyclopropylidenebicyclo[4.1.0]heptane is C1CCC2C(=C3CC3)C2C1.
What is the InChIKey of 7-cyclopropylidenebicyclo[4.1.0]heptane?
The InChIKey is OPLIWGSBCPYNMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14/c1-2-4-9-8(3-1)10(9)7-5-6-7/h8-9H,1-6H2.
What are the key properties of 7-cyclopropylidenebicyclo[4.1.0]heptane?
7-cyclopropylidenebicyclo[4.1.0]heptane has a molecular weight of 134.22 g/mol, XLogP of 2.90, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-cyclopropylidenebicyclo[4.1.0]heptane is sourced from PubChem (CID 134900897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).