About 1-dimethylphosphorylethyl(triethoxy)silane
1-dimethylphosphorylethyl(triethoxy)silane (PubChem CID 175367716) has the molecular formula C10H25O4PSi
and a molecular weight of 268.37 g/mol. Its IUPAC name is 1-dimethylphosphorylethyl(triethoxy)silane.
Molecular Properties
| Compound Name | 1-dimethylphosphorylethyl(triethoxy)silane |
| PubChem CID | 175367716 |
| Molecular Formula | C10H25O4PSi |
| Molecular Weight | 268.37 g/mol |
| Exact Mass | 268.13 |
| IUPAC Name | 1-dimethylphosphorylethyl(triethoxy)silane |
| SMILES | CCO[Si](OCC)(OCC)C(C)P(C)(C)=O |
| InChI | InChI=1S/C10H25O4PSi/c1-7-12-16(13-8-2,14-9-3)10(4)15(5,6)11/h10H,7-9H2,1-6H3 |
| InChIKey | LBHFQUMEKZXGDH-UHFFFAOYSA-N |
| XLogP | 2.59 |
| TPSA | 44.76 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 268.37 |
| LogP ≤ 5 | 2.59 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'phosphor', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 1-dimethylphosphorylethyl(triethoxy)silane?
The IUPAC name of 1-dimethylphosphorylethyl(triethoxy)silane (CID 175367716) is 1-dimethylphosphorylethyl(triethoxy)silane.
What is the SMILES notation for 1-dimethylphosphorylethyl(triethoxy)silane?
The canonical SMILES for 1-dimethylphosphorylethyl(triethoxy)silane is CCO[Si](OCC)(OCC)C(C)P(C)(C)=O.
What is the InChIKey of 1-dimethylphosphorylethyl(triethoxy)silane?
The InChIKey is LBHFQUMEKZXGDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25O4PSi/c1-7-12-16(13-8-2,14-9-3)10(4)15(5,6)11/h10H,7-9H2,1-6H3.
What are the key properties of 1-dimethylphosphorylethyl(triethoxy)silane?
1-dimethylphosphorylethyl(triethoxy)silane has a molecular weight of 268.37 g/mol, XLogP of 2.59, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-dimethylphosphorylethyl(triethoxy)silane is sourced from PubChem (CID 175367716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).