About tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane
tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane (PubChem CID 134856173) has the molecular formula C13H28OSi
and a molecular weight of 228.45 g/mol. Its IUPAC name is tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane.
Molecular Properties
| Compound Name | tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane |
| PubChem CID | 134856173 |
| Molecular Formula | C13H28OSi |
| Molecular Weight | 228.45 g/mol |
| Exact Mass | 228.19 |
| IUPAC Name | tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane |
| SMILES | C=CCC(CC)CO[Si](C)(C)C(C)(C)C |
| InChI | InChI=1S/C13H28OSi/c1-8-10-12(9-2)11-14-15(6,7)13(3,4)5/h8,12H,1,9-11H2,2-7H3 |
| InChIKey | SFJCKYJOTNQWHW-UHFFFAOYSA-N |
| XLogP | 4.61 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 228.45 |
| LogP ≤ 5 | 4.61 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane (CID 134856173) is tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane is C=CCC(CC)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane?
The InChIKey is SFJCKYJOTNQWHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28OSi/c1-8-10-12(9-2)11-14-15(6,7)13(3,4)5/h8,12H,1,9-11H2,2-7H3.
What are the key properties of tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane?
tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane has a molecular weight of 228.45 g/mol, XLogP of 4.61, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2R)-2-ethylpent-4-enoxy]-dimethylsilane is sourced from PubChem (CID 134856173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).