About (1Z)-3-prop-1-en-2-ylcyclooctene
(1Z)-3-prop-1-en-2-ylcyclooctene (PubChem CID 5367373) has the molecular formula C11H18
and a molecular weight of 150.26 g/mol. Its IUPAC name is (1Z)-3-prop-1-en-2-ylcyclooctene.
Molecular Properties
| Compound Name | (1Z)-3-prop-1-en-2-ylcyclooctene |
| PubChem CID | 5367373 |
| Molecular Formula | C11H18 |
| Molecular Weight | 150.26 g/mol |
| Exact Mass | 150.14 |
| IUPAC Name | (1Z)-3-prop-1-en-2-ylcyclooctene |
| SMILES | C=C(C)C1/C=C\CCCCC1 |
| InChI | InChI=1S/C11H18/c1-10(2)11-8-6-4-3-5-7-9-11/h6,8,11H,1,3-5,7,9H2,2H3/b8-6- |
| InChIKey | MZCVHZHOSLNLTO-VURMDHGXSA-N |
| XLogP | 3.70 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 1 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 150.26 |
| LogP ≤ 5 | 3.70 |
| 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 (1Z)-3-prop-1-en-2-ylcyclooctene?
The IUPAC name of (1Z)-3-prop-1-en-2-ylcyclooctene (CID 5367373) is (1Z)-3-prop-1-en-2-ylcyclooctene.
What is the SMILES notation for (1Z)-3-prop-1-en-2-ylcyclooctene?
The canonical SMILES for (1Z)-3-prop-1-en-2-ylcyclooctene is C=C(C)C1/C=C\CCCCC1.
What is the InChIKey of (1Z)-3-prop-1-en-2-ylcyclooctene?
The InChIKey is MZCVHZHOSLNLTO-VURMDHGXSA-N. The full InChI is InChI=1S/C11H18/c1-10(2)11-8-6-4-3-5-7-9-11/h6,8,11H,1,3-5,7,9H2,2H3/b8-6-.
What are the key properties of (1Z)-3-prop-1-en-2-ylcyclooctene?
(1Z)-3-prop-1-en-2-ylcyclooctene has a molecular weight of 150.26 g/mol, XLogP of 3.70, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1Z)-3-prop-1-en-2-ylcyclooctene is sourced from PubChem (CID 5367373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).