About 7-methylhexadecan-7-ylsilane
7-methylhexadecan-7-ylsilane (PubChem CID 173411878) has the molecular formula C17H38Si
and a molecular weight of 270.58 g/mol. Its IUPAC name is 7-methylhexadecan-7-ylsilane.
Molecular Properties
| Compound Name | 7-methylhexadecan-7-ylsilane |
| PubChem CID | 173411878 |
| Molecular Formula | C17H38Si |
| Molecular Weight | 270.58 g/mol |
| Exact Mass | 270.27 |
| IUPAC Name | 7-methylhexadecan-7-ylsilane |
| SMILES | CCCCCCCCCC(C)([SiH3])CCCCCC |
| InChI | InChI=1S/C17H38Si/c1-4-6-8-10-11-12-14-16-17(3,18)15-13-9-7-5-2/h4-16H2,1-3,18H3 |
| InChIKey | PTEXLBZXSLLNQJ-UHFFFAOYSA-N |
| XLogP | 5.64 |
| TPSA | 0.00 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | |
| Rotatable Bonds | 13 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 270.58 |
| LogP ≤ 5 | 5.64 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 0 |
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 7-methylhexadecan-7-ylsilane?
The IUPAC name of 7-methylhexadecan-7-ylsilane (CID 173411878) is 7-methylhexadecan-7-ylsilane.
What is the SMILES notation for 7-methylhexadecan-7-ylsilane?
The canonical SMILES for 7-methylhexadecan-7-ylsilane is CCCCCCCCCC(C)([SiH3])CCCCCC.
What is the InChIKey of 7-methylhexadecan-7-ylsilane?
The InChIKey is PTEXLBZXSLLNQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H38Si/c1-4-6-8-10-11-12-14-16-17(3,18)15-13-9-7-5-2/h4-16H2,1-3,18H3.
What are the key properties of 7-methylhexadecan-7-ylsilane?
7-methylhexadecan-7-ylsilane has a molecular weight of 270.58 g/mol, XLogP of 5.64, 13 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methylhexadecan-7-ylsilane is sourced from PubChem (CID 173411878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).