About 1-butoxyethenoxy-tert-butyl-dimethylsilane
1-butoxyethenoxy-tert-butyl-dimethylsilane (PubChem CID 10988079) has the molecular formula C12H26O2Si
and a molecular weight of 230.42 g/mol. Its IUPAC name is 1-butoxyethenoxy-tert-butyl-dimethylsilane.
Molecular Properties
| Compound Name | 1-butoxyethenoxy-tert-butyl-dimethylsilane |
| PubChem CID | 10988079 |
| Molecular Formula | C12H26O2Si |
| Molecular Weight | 230.42 g/mol |
| Exact Mass | 230.17 |
| IUPAC Name | 1-butoxyethenoxy-tert-butyl-dimethylsilane |
| SMILES | C=C(OCCCC)O[Si](C)(C)C(C)(C)C |
| InChI | InChI=1S/C12H26O2Si/c1-8-9-10-13-11(2)14-15(6,7)12(3,4)5/h2,8-10H2,1,3-7H3 |
| InChIKey | CHDOLVPDVFKCKP-UHFFFAOYSA-N |
| XLogP | 4.30 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 230.42 |
| LogP ≤ 5 | 4.30 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'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 1-butoxyethenoxy-tert-butyl-dimethylsilane?
The IUPAC name of 1-butoxyethenoxy-tert-butyl-dimethylsilane (CID 10988079) is 1-butoxyethenoxy-tert-butyl-dimethylsilane.
What is the SMILES notation for 1-butoxyethenoxy-tert-butyl-dimethylsilane?
The canonical SMILES for 1-butoxyethenoxy-tert-butyl-dimethylsilane is C=C(OCCCC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of 1-butoxyethenoxy-tert-butyl-dimethylsilane?
The InChIKey is CHDOLVPDVFKCKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-8-9-10-13-11(2)14-15(6,7)12(3,4)5/h2,8-10H2,1,3-7H3.
What are the key properties of 1-butoxyethenoxy-tert-butyl-dimethylsilane?
1-butoxyethenoxy-tert-butyl-dimethylsilane has a molecular weight of 230.42 g/mol, XLogP of 4.30, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butoxyethenoxy-tert-butyl-dimethylsilane is sourced from PubChem (CID 10988079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).