Back to Search
3-(Trimethylsilyl)-1-Propanol
CAS: 2917-47-7 | C6H16OSi
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2917-47-7
Molecular Formula:
C6H16OSi
Molecular Mass:
132.28 g/mol
Names and Synonyms:
3-(Trimethylsilyl)-1-Propanol
1-Propanol, 3-(trimethylsilyl)-
3-(Trimethylsilyl)-1-propanol
3-(Trimethylsilyl)propanol
3-Hydroxypropyltrimethylsilane
3-(Trimethylsilyl)propyl alcohol
1-(Trimethylsilyl)-3-propanol
NSC 96794
Identifiers:
SMILES:
C[Si](C)(C)CCCO
InChI:
InChI=1S/C6H16OSi/c1-8(2,3)6-4-5-7/h7H,4-6H2,1-3H3
Key Properties
Boiling Point
141 °C
CAS Common Chemistry
Density
0.08 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 | 132.28 g/mol | CAS Common Chemistry |
| 132.279 g/mol | RDKit | |
| 132.097041662 g/mol | RDKit | |
| Density | 0.08 g/cm³ | CAS Common Chemistry |
| 0.0832 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 141 °C | CAS Common Chemistry |
| Canonical SMILES | OCCC[Si](C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C6H16OSi/c1-8(2,3)6-4-5-7/h7H,4-6H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=YNUUCDHAZGAVEZ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 3-(Trimethylsilyl)-1-propanol | CAS Common Chemistry |
| Heavy Atom Count | 8 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 20.23 Ų | RDKit |
| LogP | 1.7069999999999999 | RDKit |
| Molar Refractivity | 39.8558 | RDKit |
