About 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol
6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol (PubChem CID 91086338) has the molecular formula C16H32OSi
and a molecular weight of 268.52 g/mol. Its IUPAC name is 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol.
Molecular Properties
| Compound Name | 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol |
| PubChem CID | 91086338 |
| Molecular Formula | C16H32OSi |
| Molecular Weight | 268.52 g/mol |
| Exact Mass | 268.22 |
| IUPAC Name | 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol |
| SMILES | C=CCCCCCC[Si](C)(C)C=CCCCCO |
| InChI | InChI=1S/C16H32OSi/c1-4-5-6-7-9-12-15-18(2,3)16-13-10-8-11-14-17/h4,13,16-17H,1,5-12,14-15H2,2-3H3 |
| InChIKey | HZQKMJILXIKESV-UHFFFAOYSA-N |
| XLogP | 5.09 |
| TPSA | 20.23 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 268.52 |
| LogP ≤ 5 | 5.09 |
| 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': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol?
The IUPAC name of 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol (CID 91086338) is 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol.
What is the SMILES notation for 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol?
The canonical SMILES for 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol is C=CCCCCCC[Si](C)(C)C=CCCCCO.
What is the InChIKey of 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol?
The InChIKey is HZQKMJILXIKESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32OSi/c1-4-5-6-7-9-12-15-18(2,3)16-13-10-8-11-14-17/h4,13,16-17H,1,5-12,14-15H2,2-3H3.
What are the key properties of 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol?
6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol has a molecular weight of 268.52 g/mol, XLogP of 5.09, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[dimethyl(oct-7-enyl)silyl]hex-5-en-1-ol is sourced from PubChem (CID 91086338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).