About [(1R)-1-nonylcyclopent-2-en-1-yl]methanol
[(1R)-1-nonylcyclopent-2-en-1-yl]methanol (PubChem CID 11644265) has the molecular formula C15H28O
and a molecular weight of 224.39 g/mol. Its IUPAC name is [(1R)-1-nonylcyclopent-2-en-1-yl]methanol.
Molecular Properties
| Compound Name | [(1R)-1-nonylcyclopent-2-en-1-yl]methanol |
| PubChem CID | 11644265 |
| Molecular Formula | C15H28O |
| Molecular Weight | 224.39 g/mol |
| Exact Mass | 224.21 |
| IUPAC Name | [(1R)-1-nonylcyclopent-2-en-1-yl]methanol |
| SMILES | CCCCCCCCC[C@]1(CO)C=CCC1 |
| InChI | InChI=1S/C15H28O/c1-2-3-4-5-6-7-8-11-15(14-16)12-9-10-13-15/h9,12,16H,2-8,10-11,13-14H2,1H3/t15-/m0/s1 |
| InChIKey | JZPJCXPYUWZFNL-HNNXBMFYSA-N |
| XLogP | 4.46 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 224.39 |
| LogP ≤ 5 | 4.46 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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 [(1R)-1-nonylcyclopent-2-en-1-yl]methanol?
The IUPAC name of [(1R)-1-nonylcyclopent-2-en-1-yl]methanol (CID 11644265) is [(1R)-1-nonylcyclopent-2-en-1-yl]methanol.
What is the SMILES notation for [(1R)-1-nonylcyclopent-2-en-1-yl]methanol?
The canonical SMILES for [(1R)-1-nonylcyclopent-2-en-1-yl]methanol is CCCCCCCCC[C@]1(CO)C=CCC1.
What is the InChIKey of [(1R)-1-nonylcyclopent-2-en-1-yl]methanol?
The InChIKey is JZPJCXPYUWZFNL-HNNXBMFYSA-N. The full InChI is InChI=1S/C15H28O/c1-2-3-4-5-6-7-8-11-15(14-16)12-9-10-13-15/h9,12,16H,2-8,10-11,13-14H2,1H3/t15-/m0/s1.
What are the key properties of [(1R)-1-nonylcyclopent-2-en-1-yl]methanol?
[(1R)-1-nonylcyclopent-2-en-1-yl]methanol has a molecular weight of 224.39 g/mol, XLogP of 4.46, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1-nonylcyclopent-2-en-1-yl]methanol is sourced from PubChem (CID 11644265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).