About decyl-methyl-(2-phenoxyethoxy)silane
decyl-methyl-(2-phenoxyethoxy)silane (PubChem CID 154383933) has the molecular formula C19H34O2Si
and a molecular weight of 322.56 g/mol. Its IUPAC name is decyl-methyl-(2-phenoxyethoxy)silane.
Molecular Properties
| Compound Name | decyl-methyl-(2-phenoxyethoxy)silane |
| PubChem CID | 154383933 |
| Molecular Formula | C19H34O2Si |
| Molecular Weight | 322.56 g/mol |
| Exact Mass | 322.23 |
| IUPAC Name | decyl-methyl-(2-phenoxyethoxy)silane |
| SMILES | CCCCCCCCCC[SiH](C)OCCOc1ccccc1 |
| InChI | InChI=1S/C19H34O2Si/c1-3-4-5-6-7-8-9-13-18-22(2)21-17-16-20-19-14-11-10-12-15-19/h10-12,14-15,22H,3-9,13,16-18H2,1-2H3 |
| InChIKey | RSLZGGCIQSWZBP-UHFFFAOYSA-N |
| XLogP | 5.58 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 14 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 322.56 |
| LogP ≤ 5 | 5.58 |
| 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-(2-phenoxyethoxy)silane?
The IUPAC name of decyl-methyl-(2-phenoxyethoxy)silane (CID 154383933) is decyl-methyl-(2-phenoxyethoxy)silane.
What is the SMILES notation for decyl-methyl-(2-phenoxyethoxy)silane?
The canonical SMILES for decyl-methyl-(2-phenoxyethoxy)silane is CCCCCCCCCC[SiH](C)OCCOc1ccccc1.
What is the InChIKey of decyl-methyl-(2-phenoxyethoxy)silane?
The InChIKey is RSLZGGCIQSWZBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34O2Si/c1-3-4-5-6-7-8-9-13-18-22(2)21-17-16-20-19-14-11-10-12-15-19/h10-12,14-15,22H,3-9,13,16-18H2,1-2H3.
What are the key properties of decyl-methyl-(2-phenoxyethoxy)silane?
decyl-methyl-(2-phenoxyethoxy)silane has a molecular weight of 322.56 g/mol, XLogP of 5.58, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for decyl-methyl-(2-phenoxyethoxy)silane is sourced from PubChem (CID 154383933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).