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Trimethyl(2-Propyn-1-Yloxy)Silane
CAS: 5582-62-7 | C6H12OSi
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
5582-62-7
Molecular Formula:
C6H12OSi
Molecular Mass:
128.25 g/mol
Names and Synonyms:
Trimethyl(2-Propyn-1-Yloxy)Silane
Silane, trimethyl(2-propyn-1-yloxy)-
Silane, trimethyl(2-propynyloxy)-
Trimethyl(2-propyn-1-yloxy)silane
Propargyl trimethylsilyl ether
1-(Trimethylsiloxy)-2-propyne
Trimethyl(propargyloxy)silane
3-(Trimethylsilyloxy)propyne
Trimethyl(2-propynyloxy)silane
3-(Trimethylsiloxy)-1-propyne
O-(Trimethylsilyl)propargyl alcohol
Propargyloxytrimethylsilane
(2-Propynyloxy)trimethylsilane
3-(Trimethylsilyloxy)-1-propyne
Identifiers:
SMILES:
C#CCO[Si](C)(C)C
InChI:
InChI=1S/C6H12OSi/c1-5-6-7-8(2,3)4/h1H,6H2,2-4H3
Key Properties
Boiling Point
110-111 °C
CAS Common Chemistry
Density
0.83 g/cm³
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 128.25 g/mol | CAS Common Chemistry |
| 128.24699999999999 g/mol | RDKit | |
| 128.065741534 g/mol | RDKit | |
| Density | 0.83 g/cm³ | CAS Common Chemistry |
| 0.833 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 110-111 °C | CAS Common Chemistry |
| Canonical SMILES | C#CCO[Si](C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C6H12OSi/c1-5-6-7-8(2,3)4/h1H,6H2,2-4H3 | CAS Common Chemistry |
| InChI Key | InChIKey=ZZRPJWCNCLSOLR-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Trimethyl(2-propyn-1-yloxy)silane | CAS Common Chemistry |
| Heavy Atom Count | 8 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 9.23 Ų | RDKit |
| LogP | 1.4711 | RDKit |
| Molar Refractivity | 38.13100000000001 | RDKit |
