About (5R)-7-phenyldec-9-en-5-ol
(5R)-7-phenyldec-9-en-5-ol (PubChem CID 134965025) has the molecular formula C16H24O
and a molecular weight of 232.37 g/mol. Its IUPAC name is (5R)-7-phenyldec-9-en-5-ol.
Molecular Properties
| Compound Name | (5R)-7-phenyldec-9-en-5-ol |
| PubChem CID | 134965025 |
| Molecular Formula | C16H24O |
| Molecular Weight | 232.37 g/mol |
| Exact Mass | 232.18 |
| IUPAC Name | (5R)-7-phenyldec-9-en-5-ol |
| SMILES | C=CCC(C[C@H](O)CCCC)c1ccccc1 |
| InChI | InChI=1S/C16H24O/c1-3-5-12-16(17)13-15(9-4-2)14-10-7-6-8-11-14/h4,6-8,10-11,15-17H,2-3,5,9,12-13H2,1H3/t15?,16-/m1/s1 |
| InChIKey | XLCMWMXUPZIROW-OEMAIJDKSA-N |
| XLogP | 4.29 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 232.37 |
| LogP ≤ 5 | 4.29 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
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 (5R)-7-phenyldec-9-en-5-ol?
The IUPAC name of (5R)-7-phenyldec-9-en-5-ol (CID 134965025) is (5R)-7-phenyldec-9-en-5-ol.
What is the SMILES notation for (5R)-7-phenyldec-9-en-5-ol?
The canonical SMILES for (5R)-7-phenyldec-9-en-5-ol is C=CCC(C[C@H](O)CCCC)c1ccccc1.
What is the InChIKey of (5R)-7-phenyldec-9-en-5-ol?
The InChIKey is XLCMWMXUPZIROW-OEMAIJDKSA-N. The full InChI is InChI=1S/C16H24O/c1-3-5-12-16(17)13-15(9-4-2)14-10-7-6-8-11-14/h4,6-8,10-11,15-17H,2-3,5,9,12-13H2,1H3/t15?,16-/m1/s1.
What are the key properties of (5R)-7-phenyldec-9-en-5-ol?
(5R)-7-phenyldec-9-en-5-ol has a molecular weight of 232.37 g/mol, XLogP of 4.29, 8 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-7-phenyldec-9-en-5-ol is sourced from PubChem (CID 134965025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).