About decyl-methyl-dipropoxysilane
decyl-methyl-dipropoxysilane (PubChem CID 22228658) has the molecular formula C17H38O2Si
and a molecular weight of 302.57 g/mol. Its IUPAC name is decyl-methyl-dipropoxysilane.
Molecular Properties
| Compound Name | decyl-methyl-dipropoxysilane |
| PubChem CID | 22228658 |
| Molecular Formula | C17H38O2Si |
| Molecular Weight | 302.57 g/mol |
| Exact Mass | 302.26 |
| IUPAC Name | decyl-methyl-dipropoxysilane |
| SMILES | CCCCCCCCCC[Si](C)(OCCC)OCCC |
| InChI | InChI=1S/C17H38O2Si/c1-5-8-9-10-11-12-13-14-17-20(4,18-15-6-2)19-16-7-3/h5-17H2,1-4H3 |
| InChIKey | ZEVHLEMQTJNUCF-UHFFFAOYSA-N |
| XLogP | 6.05 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 15 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 302.57 |
| LogP ≤ 5 | 6.05 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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 decyl-methyl-dipropoxysilane?
The IUPAC name of decyl-methyl-dipropoxysilane (CID 22228658) is decyl-methyl-dipropoxysilane.
What is the SMILES notation for decyl-methyl-dipropoxysilane?
The canonical SMILES for decyl-methyl-dipropoxysilane is CCCCCCCCCC[Si](C)(OCCC)OCCC.
What is the InChIKey of decyl-methyl-dipropoxysilane?
The InChIKey is ZEVHLEMQTJNUCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38O2Si/c1-5-8-9-10-11-12-13-14-17-20(4,18-15-6-2)19-16-7-3/h5-17H2,1-4H3.
What are the key properties of decyl-methyl-dipropoxysilane?
decyl-methyl-dipropoxysilane has a molecular weight of 302.57 g/mol, XLogP of 6.05, 15 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for decyl-methyl-dipropoxysilane is sourced from PubChem (CID 22228658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).