About tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane
tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane (PubChem CID 134916503) has the molecular formula C17H34OSi
and a molecular weight of 282.54 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane.
Molecular Properties
| Compound Name | tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane |
| PubChem CID | 134916503 |
| Molecular Formula | C17H34OSi |
| Molecular Weight | 282.54 g/mol |
| Exact Mass | 282.24 |
| IUPAC Name | tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane |
| SMILES | C=C(/C=C/CCCCCC)CO[Si](C)(C)C(C)(C)C |
| InChI | InChI=1S/C17H34OSi/c1-8-9-10-11-12-13-14-16(2)15-18-19(6,7)17(3,4)5/h13-14H,2,8-12,15H2,1,3-7H3/b14-13+ |
| InChIKey | RIILXHGLGILGPG-BUHFOSPRSA-N |
| XLogP | 6.09 |
| TPSA | 9.23 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 9 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 282.54 |
| LogP ≤ 5 | 6.09 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane (CID 134916503) is tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane is C=C(/C=C/CCCCCC)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane?
The InChIKey is RIILXHGLGILGPG-BUHFOSPRSA-N. The full InChI is InChI=1S/C17H34OSi/c1-8-9-10-11-12-13-14-16(2)15-18-19(6,7)17(3,4)5/h13-14H,2,8-12,15H2,1,3-7H3/b14-13+.
What are the key properties of tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane?
tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane has a molecular weight of 282.54 g/mol, XLogP of 6.09, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(E)-2-methylidenedec-3-enoxy]silane is sourced from PubChem (CID 134916503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).