About tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane
tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane (PubChem CID 10496032) has the molecular formula C9H19Cl3O2Si2
and a molecular weight of 321.78 g/mol. Its IUPAC name is tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane.
Molecular Properties
| Compound Name | tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane |
| PubChem CID | 10496032 |
| Molecular Formula | C9H19Cl3O2Si2 |
| Molecular Weight | 321.78 g/mol |
| Exact Mass | 320.00 |
| IUPAC Name | tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane |
| SMILES | C=C(CO[Si](C)(C)C(C)(C)C)O[Si](Cl)(Cl)Cl |
| InChI | InChI=1S/C9H19Cl3O2Si2/c1-8(14-16(10,11)12)7-13-15(5,6)9(2,3)4/h1,7H2,2-6H3 |
| InChIKey | FAYXCSPBJZKNKJ-UHFFFAOYSA-N |
| XLogP | 4.69 |
| TPSA | 18.46 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 321.78 |
| LogP ≤ 5 | 4.69 |
| 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': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'silicon_halogen', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane?
The IUPAC name of tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane (CID 10496032) is tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane is C=C(CO[Si](C)(C)C(C)(C)C)O[Si](Cl)(Cl)Cl.
What is the InChIKey of tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane?
The InChIKey is FAYXCSPBJZKNKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19Cl3O2Si2/c1-8(14-16(10,11)12)7-13-15(5,6)9(2,3)4/h1,7H2,2-6H3.
What are the key properties of tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane?
tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane has a molecular weight of 321.78 g/mol, XLogP of 4.69, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(2-trichlorosilyloxyprop-2-enoxy)silane is sourced from PubChem (CID 10496032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).