About butyl-decyl-dimethoxysilane
butyl-decyl-dimethoxysilane (PubChem CID 141135588) has the molecular formula C16H36O2Si
and a molecular weight of 288.55 g/mol. Its IUPAC name is butyl-decyl-dimethoxysilane.
Molecular Properties
| Compound Name | butyl-decyl-dimethoxysilane |
| PubChem CID | 141135588 |
| Molecular Formula | C16H36O2Si |
| Molecular Weight | 288.55 g/mol |
| Exact Mass | 288.25 |
| IUPAC Name | butyl-decyl-dimethoxysilane |
| SMILES | CCCCCCCCCC[Si](CCCC)(OC)OC |
| InChI | InChI=1S/C16H36O2Si/c1-5-7-9-10-11-12-13-14-16-19(17-3,18-4)15-8-6-2/h5-16H2,1-4H3 |
| InChIKey | AIQTYDOOTMWUMZ-UHFFFAOYSA-N |
| XLogP | 5.66 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 288.55 |
| LogP ≤ 5 | 5.66 |
| 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 butyl-decyl-dimethoxysilane?
The IUPAC name of butyl-decyl-dimethoxysilane (CID 141135588) is butyl-decyl-dimethoxysilane.
What is the SMILES notation for butyl-decyl-dimethoxysilane?
The canonical SMILES for butyl-decyl-dimethoxysilane is CCCCCCCCCC[Si](CCCC)(OC)OC.
What is the InChIKey of butyl-decyl-dimethoxysilane?
The InChIKey is AIQTYDOOTMWUMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O2Si/c1-5-7-9-10-11-12-13-14-16-19(17-3,18-4)15-8-6-2/h5-16H2,1-4H3.
What are the key properties of butyl-decyl-dimethoxysilane?
butyl-decyl-dimethoxysilane has a molecular weight of 288.55 g/mol, XLogP of 5.66, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-decyl-dimethoxysilane is sourced from PubChem (CID 141135588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).