HuagongsheHuagongshe Chemistry Print Report · For research reference only
tert-Butyl chloro(trimethylsilyl)acetate
REVBFXGFKCMPSR-UHFFFAOYSA-N · t-Butyl 2-Chloro-2-trimethylsilylacetate · tert-Butyl-2-chloro-2-trimethylsilylacetate · Acetic acid, 2-chloro-2-(trimethylsilyl)-, 1,1-dimethylethyl ester · tert-Butyl-2-chloro-2-trimethylsilylacetate**CUSTOMSYNTHESISPLEASEASK**
Identifiers & Physical Properties
| CAS No. | 66406-43-7 |
|---|---|
| Molecular formula | C9H19ClO2Si |
| Average molar mass | 222.78 g/mol |
| Monoisotopic mass | 222.08428406 g/mol |
| SMILES | CC(C)(C)OC(=O)C(Cl)[Si](C)(C)C |
| InChIKey | REVBFXGFKCMPSR-UHFFFAOYSA-N |
| PubChem CID | 15251663 |
| DTXSID | DTXSID50570480 |
Chemical & Physical Properties
| Topological polar surface area | 26.3 |
|---|---|
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 2 |
| Rotatable bonds | 4 |
| Heavy atoms | 13 |
| Formal charge | 0 |
| Complexity | 191 |
| Boiling point | 221.2±20.0 °C(Predicted) |
| Density | 0.976±0.06 g/cm3(Predicted) |
Preparation & Synthesis
Preparation
Tert-butyl-2-chloro-2-trimethylsilylacetate is prepared from t-Butyl Chloroacetate by sequential reaction with Lithium Diisopropylamide and Chlorotrimethylsilane followed by aqueous workup and distillation.