About butoxy-dimethyl-non-5-yn-3-yloxysilane
butoxy-dimethyl-non-5-yn-3-yloxysilane (PubChem CID 91730323) has the molecular formula C15H30O2Si
and a molecular weight of 270.49 g/mol. Its IUPAC name is butoxy-dimethyl-non-5-yn-3-yloxysilane.
Molecular Properties
| Compound Name | butoxy-dimethyl-non-5-yn-3-yloxysilane |
| PubChem CID | 91730323 |
| Molecular Formula | C15H30O2Si |
| Molecular Weight | 270.49 g/mol |
| Exact Mass | 270.20 |
| IUPAC Name | butoxy-dimethyl-non-5-yn-3-yloxysilane |
| SMILES | CCCC#CCC(CC)O[Si](C)(C)OCCCC |
| InChI | InChI=1S/C15H30O2Si/c1-6-9-11-12-13-15(8-3)17-18(4,5)16-14-10-7-2/h15H,6-10,13-14H2,1-5H3 |
| InChIKey | MYJLPWXBSICPLG-UHFFFAOYSA-N |
| XLogP | 4.49 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 270.49 |
| LogP ≤ 5 | 4.49 |
| 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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of butoxy-dimethyl-non-5-yn-3-yloxysilane?
The IUPAC name of butoxy-dimethyl-non-5-yn-3-yloxysilane (CID 91730323) is butoxy-dimethyl-non-5-yn-3-yloxysilane.
What is the SMILES notation for butoxy-dimethyl-non-5-yn-3-yloxysilane?
The canonical SMILES for butoxy-dimethyl-non-5-yn-3-yloxysilane is CCCC#CCC(CC)O[Si](C)(C)OCCCC.
What is the InChIKey of butoxy-dimethyl-non-5-yn-3-yloxysilane?
The InChIKey is MYJLPWXBSICPLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30O2Si/c1-6-9-11-12-13-15(8-3)17-18(4,5)16-14-10-7-2/h15H,6-10,13-14H2,1-5H3.
What are the key properties of butoxy-dimethyl-non-5-yn-3-yloxysilane?
butoxy-dimethyl-non-5-yn-3-yloxysilane has a molecular weight of 270.49 g/mol, XLogP of 4.49, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butoxy-dimethyl-non-5-yn-3-yloxysilane is sourced from PubChem (CID 91730323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).