About Propyldimethoxysilane
Propyldimethoxysilane (PubChem CID 12034197) has the molecular formula C5H13O2Si
and a molecular weight of 133.24 g/mol.
Molecular Properties
| Compound Name | Propyldimethoxysilane |
| PubChem CID | 12034197 |
| Molecular Formula | C5H13O2Si |
| Molecular Weight | 133.24 g/mol |
| Exact Mass | 133.07 |
| IUPAC Name | — |
| SMILES | CCC[Si](OC)OC |
| InChI | InChI=1S/C5H13O2Si/c1-4-5-8(6-2)7-3/h4-5H2,1-3H3 |
| InChIKey | PLVIRNBJZITIKW-UHFFFAOYSA-N |
| XLogP | 1.18 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 8 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 133.24 |
| LogP ≤ 5 | 1.18 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of Propyldimethoxysilane?
The IUPAC name of Propyldimethoxysilane (CID 12034197) is not available.
What is the SMILES notation for Propyldimethoxysilane?
The canonical SMILES for Propyldimethoxysilane is CCC[Si](OC)OC.
What is the InChIKey of Propyldimethoxysilane?
The InChIKey is PLVIRNBJZITIKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13O2Si/c1-4-5-8(6-2)7-3/h4-5H2,1-3H3.
What are the key properties of Propyldimethoxysilane?
Propyldimethoxysilane has a molecular weight of 133.24 g/mol, XLogP of 1.18, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for Propyldimethoxysilane is sourced from PubChem (CID 12034197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).