About butyl-dimethyl-(3-methylbut-2-enoxy)silane
butyl-dimethyl-(3-methylbut-2-enoxy)silane (PubChem CID 531325) has the molecular formula C11H24OSi
and a molecular weight of 200.40 g/mol. Its IUPAC name is butyl-dimethyl-(3-methylbut-2-enoxy)silane.
Molecular Properties
| Compound Name | butyl-dimethyl-(3-methylbut-2-enoxy)silane |
| PubChem CID | 531325 |
| Molecular Formula | C11H24OSi |
| Molecular Weight | 200.40 g/mol |
| Exact Mass | 200.16 |
| IUPAC Name | butyl-dimethyl-(3-methylbut-2-enoxy)silane |
| SMILES | CCCC[Si](C)(C)OCC=C(C)C |
| InChI | InChI=1S/C11H24OSi/c1-6-7-10-13(4,5)12-9-8-11(2)3/h8H,6-7,9-10H2,1-5H3 |
| InChIKey | IMMDTUZMMDCMAM-UHFFFAOYSA-N |
| XLogP | 3.97 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 13 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 200.40 |
| LogP ≤ 5 | 3.97 |
| 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 butyl-dimethyl-(3-methylbut-2-enoxy)silane?
The IUPAC name of butyl-dimethyl-(3-methylbut-2-enoxy)silane (CID 531325) is butyl-dimethyl-(3-methylbut-2-enoxy)silane.
What is the SMILES notation for butyl-dimethyl-(3-methylbut-2-enoxy)silane?
The canonical SMILES for butyl-dimethyl-(3-methylbut-2-enoxy)silane is CCCC[Si](C)(C)OCC=C(C)C.
What is the InChIKey of butyl-dimethyl-(3-methylbut-2-enoxy)silane?
The InChIKey is IMMDTUZMMDCMAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24OSi/c1-6-7-10-13(4,5)12-9-8-11(2)3/h8H,6-7,9-10H2,1-5H3.
What are the key properties of butyl-dimethyl-(3-methylbut-2-enoxy)silane?
butyl-dimethyl-(3-methylbut-2-enoxy)silane has a molecular weight of 200.40 g/mol, XLogP of 3.97, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for butyl-dimethyl-(3-methylbut-2-enoxy)silane is sourced from PubChem (CID 531325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).