About dec-8-en-4-ol
dec-8-en-4-ol (PubChem CID 56606618) has the molecular formula C10H20O
and a molecular weight of 156.27 g/mol. Its IUPAC name is dec-8-en-4-ol.
Molecular Properties
| Compound Name | dec-8-en-4-ol |
| PubChem CID | 56606618 |
| Molecular Formula | C10H20O |
| Molecular Weight | 156.27 g/mol |
| Exact Mass | 156.15 |
| IUPAC Name | dec-8-en-4-ol |
| SMILES | CC=CCCCC(O)CCC |
| InChI | InChI=1S/C10H20O/c1-3-5-6-7-9-10(11)8-4-2/h3,5,10-11H,4,6-9H2,1-2H3 |
| InChIKey | ITHCYMXSNPFGLD-UHFFFAOYSA-N |
| XLogP | 2.89 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 156.27 |
| LogP ≤ 5 | 2.89 |
| 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 dec-8-en-4-ol?
The IUPAC name of dec-8-en-4-ol (CID 56606618) is dec-8-en-4-ol.
What is the SMILES notation for dec-8-en-4-ol?
The canonical SMILES for dec-8-en-4-ol is CC=CCCCC(O)CCC.
What is the InChIKey of dec-8-en-4-ol?
The InChIKey is ITHCYMXSNPFGLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O/c1-3-5-6-7-9-10(11)8-4-2/h3,5,10-11H,4,6-9H2,1-2H3.
What are the key properties of dec-8-en-4-ol?
dec-8-en-4-ol has a molecular weight of 156.27 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dec-8-en-4-ol is sourced from PubChem (CID 56606618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).