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Molecule
2,5-Dioxo-1-Pyrrolidinyl [2-(Trimethylsilyl)Ethyl] Carbonate
CAS: 78269-85-9 · C10H17NO5Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 78269-85-9
- Molecular Formula
- C10H17NO5Si
- Molecular Mass
- 259.33 g/mol
Identifiers
CAS Registry Number
78269-85-9
SMILES
C[Si](C)(C)CCOC(=O)ON1C(=O)CCC1=O
InChI Key
FLDNDAMSCINJDX-UHFFFAOYSA-N
InChI
InChI=1S/C10H17NO5Si/c1-17(2,3)7-6-15-10(14)16-11-8(12)4-5-9(11)13/h4-7H2,1-3H3
Names and Synonyms
- 2,5-Dioxo-1-Pyrrolidinyl [2-(Trimethylsilyl)Ethyl] Carbonate Systematic Name
- Carbonic acid, 2,5-dioxo-1-pyrrolidinyl [2-(trimethylsilyl)ethyl] ester Synonym
- 2,5-Pyrrolidinedione, 1-[[[2-(trimethylsilyl)ethoxy]carbonyl]oxy]- Synonym
- 2,5-Dioxo-1-pyrrolidinyl [2-(trimethylsilyl)ethyl] carbonate Synonym
- 1-[[[2-(Trimethylsilyl)ethoxy]carbonyl]oxy]pyrrolidin-2,5-dione Synonym
- 1-[[[2-(Trimethylsilyl)ethoxy]carbonyl]oxy]pyrrolidine-2,5-dione Synonym
- 1-[[[[2-(Trimethylsilyl)ethyl]oxy]carbonyl]oxy]-2,5-pyrrolidinedione Synonym
- 2,5-Dioxopyrrolidin-1-yl 2-(trimethylsilyl)ethyl carbonate Synonym
- N-[[[(2-Trimethylsilylethyl)oxy]carbonyl]oxy]succinimide Synonym
- Teoc-OSu Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 259.33 g/mol | CAS Common Chemistry |
| 259.33399999999995 g/mol | RDKit | |
| 259.334 g/mol | RDKit | |
| Canonical SMILES | O=C(ON1C(=O)CCC1=O)OCC[Si](C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C10H17NO5Si/c1-17(2,3)7-6-15-10(14)16-11-8(12)4-5-9(11)13/h4-7H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=FLDNDAMSCINJDX-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 97.5-98.5 °C @ Solvent: Hexane | CAS Common Chemistry |
| Name | 2,5-Dioxo-1-pyrrolidinyl [2-(trimethylsilyl)ethyl] carbonate | CAS Common Chemistry |
| Heavy Atom Count | 17 | RDKit |
| Hydrogen Bond Acceptors | 5 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 72.91 Ų | RDKit |
| 72.68 Ų | chempirical lib | |
| LogP | 1.5417999999999998 | RDKit |
| 1.5418 | RDKit | |
| 1.44 | chempirical lib | |
| Molar Refractivity | 61.67300000000004 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.7 | RDKit |
| Exact Mass | 259.087599174 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
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200 ppm
180
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
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MW = 259.33 g/mol. Edit any field — others recompute live.
