About dodecoxy-dimethyl-octylsilane
dodecoxy-dimethyl-octylsilane (PubChem CID 618139) has the molecular formula C22H48OSi
and a molecular weight of 356.71 g/mol. Its IUPAC name is dodecoxy-dimethyl-octylsilane.
Molecular Properties
| Compound Name | dodecoxy-dimethyl-octylsilane |
| PubChem CID | 618139 |
| Molecular Formula | C22H48OSi |
| Molecular Weight | 356.71 g/mol |
| Exact Mass | 356.35 |
| IUPAC Name | dodecoxy-dimethyl-octylsilane |
| SMILES | CCCCCCCCCCCCO[Si](C)(C)CCCCCCCC |
| InChI | InChI=1S/C22H48OSi/c1-5-7-9-11-13-14-15-16-17-19-21-23-24(3,4)22-20-18-12-10-8-6-2/h5-22H2,1-4H3 |
| InChIKey | RVCANALKIOSJOU-UHFFFAOYSA-N |
| XLogP | 8.49 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 19 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 356.71 |
| LogP ≤ 5 | 8.49 |
| H-Bond Donors ≤ 5 | 0 |
| 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'} |
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Frequently Asked Questions
What is the IUPAC name of dodecoxy-dimethyl-octylsilane?
The IUPAC name of dodecoxy-dimethyl-octylsilane (CID 618139) is dodecoxy-dimethyl-octylsilane.
What is the SMILES notation for dodecoxy-dimethyl-octylsilane?
The canonical SMILES for dodecoxy-dimethyl-octylsilane is CCCCCCCCCCCCO[Si](C)(C)CCCCCCCC.
What is the InChIKey of dodecoxy-dimethyl-octylsilane?
The InChIKey is RVCANALKIOSJOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H48OSi/c1-5-7-9-11-13-14-15-16-17-19-21-23-24(3,4)22-20-18-12-10-8-6-2/h5-22H2,1-4H3.
What are the key properties of dodecoxy-dimethyl-octylsilane?
dodecoxy-dimethyl-octylsilane has a molecular weight of 356.71 g/mol, XLogP of 8.49, 19 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dodecoxy-dimethyl-octylsilane is sourced from PubChem (CID 618139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).