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Molecule
[(3-Methoxy-1-Methylene-2-Propen-1-Yl)Oxy]Trimethylsilane
CAS: 59414-23-2 · C8H16O2Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 59414-23-2
- Molecular Formula
- C8H16O2Si
- Molecular Mass
- 172.30 g/mol
Identifiers
CAS Registry Number
59414-23-2
SMILES
C=C(C=COC)O[Si](C)(C)C
InChI Key
SHALBPKEGDBVKK-UHFFFAOYSA-N
InChI
InChI=1S/C8H16O2Si/c1-8(6-7-9-2)10-11(3,4)5/h6-7H,1H2,2-5H3
Names and Synonyms
- [(3-Methoxy-1-Methylene-2-Propen-1-Yl)Oxy]Trimethylsilane Synonym
- Silane, [(3-methoxy-1-methylene-2-propen-1-yl)oxy]trimethyl- Synonym
- Silane, [(3-methoxy-1-methylene-2-propenyl)oxy]trimethyl- Synonym
- [(3-Methoxy-1-methylene-2-propen-1-yl)oxy]trimethylsilane Synonym
- 1-Methoxy-3-(trimethylsiloxy)-1,3-butadiene Synonym
- 1-Methoxy-3-(trimethylsiloxy)butadiene Synonym
- 1-Methoxy-3-trimethylsilyloxy-1,3-butadiene Synonym
- 4-Methoxy-2-trimethylsiloxy-1,3-butadiene Synonym
- [(3-Methoxy-1-methylene-2-propenyl)oxy]trimethylsilane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 172.30 g/mol | CAS Common Chemistry |
| 172.29999999999998 g/mol | RDKit | |
| 172.3 g/mol | RDKit | |
| Canonical SMILES | O(C=CC(O[Si](C)(C)C)=C)C | CAS Common Chemistry |
| InChI | InChI=1S/C8H16O2Si/c1-8(6-7-9-2)10-11(3,4)5/h6-7H,1H2,2-5H3 | CAS Common Chemistry |
| InChI Key | InChIKey=SHALBPKEGDBVKK-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | [(3-Methoxy-1-methylene-2-propen-1-yl)oxy]trimethylsilane | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 18.46 Ų | RDKit |
| LogP | 2.5117000000000003 | RDKit |
| 2.5117 | RDKit | |
| 2.32 | chempirical lib | |
| Molar Refractivity | 49.720000000000034 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.5 | RDKit |
| Exact Mass | 172.091956282 g/mol | RDKit |
| Boiling Point | 65-70 °C @ 7 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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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.
External Resources
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MW = 172.30 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C8H16O2Si.
