About trimethyl(16-methyloctadecoxy)silane
trimethyl(16-methyloctadecoxy)silane (PubChem CID 526071) has the molecular formula C22H48OSi
and a molecular weight of 356.71 g/mol. Its IUPAC name is trimethyl(16-methyloctadecoxy)silane.
Molecular Properties
| Compound Name | trimethyl(16-methyloctadecoxy)silane |
| PubChem CID | 526071 |
| Molecular Formula | C22H48OSi |
| Molecular Weight | 356.71 g/mol |
| Exact Mass | 356.35 |
| IUPAC Name | trimethyl(16-methyloctadecoxy)silane |
| SMILES | CCC(C)CCCCCCCCCCCCCCCO[Si](C)(C)C |
| InChI | InChI=1S/C22H48OSi/c1-6-22(2)20-18-16-14-12-10-8-7-9-11-13-15-17-19-21-23-24(3,4)5/h22H,6-21H2,1-5H3 |
| InChIKey | RSUTYIKJJGPCMW-UHFFFAOYSA-N |
| XLogP | 8.35 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 356.71 |
| LogP ≤ 5 | 8.35 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
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 trimethyl(16-methyloctadecoxy)silane?
The IUPAC name of trimethyl(16-methyloctadecoxy)silane (CID 526071) is trimethyl(16-methyloctadecoxy)silane.
What is the SMILES notation for trimethyl(16-methyloctadecoxy)silane?
The canonical SMILES for trimethyl(16-methyloctadecoxy)silane is CCC(C)CCCCCCCCCCCCCCCO[Si](C)(C)C.
What is the InChIKey of trimethyl(16-methyloctadecoxy)silane?
The InChIKey is RSUTYIKJJGPCMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H48OSi/c1-6-22(2)20-18-16-14-12-10-8-7-9-11-13-15-17-19-21-23-24(3,4)5/h22H,6-21H2,1-5H3.
What are the key properties of trimethyl(16-methyloctadecoxy)silane?
trimethyl(16-methyloctadecoxy)silane has a molecular weight of 356.71 g/mol, XLogP of 8.35, 18 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(16-methyloctadecoxy)silane is sourced from PubChem (CID 526071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).