Back to Search
Triethylsilanol
CAS: 597-52-4 | C6H16OSi
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
597-52-4
Molecular Formula:
C6H16OSi
Molecular Weight:
132.279 g/mol
Names and Synonyms:
Triethylsilanol
Silanol, 1,1,1-triethyl-
Silanol, triethyl-
1,1,1-Triethylsilanol
Triethylsilanol
Triethylhydroxysilane
Triethylsilyl hydroxide
Hydroxytriethylsilane
T 2017
Identifiers:
SMILES:
CC[Si](O)(CC)CC
InChI:
InChI=1S/C6H16OSi/c1-4-8(7,5-2)6-3/h7H,4-6H2,1-3H3
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 132.279 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 132.097041662 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 8 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 1 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 3 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 20.23 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | 1.9838999999999998 | RDKit |
| molecular_mass | 132.28 g/mol | Legacy Database |
| density | 0.86 g/cm³ | Legacy Database |
| cas-boiling-point | 154 °C None | Legacy Database |
| cas-canonical-smile | O[Si](CC)(CC)CC None | Legacy Database |
| cas-density | 0.864 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/C6H16OSi/c1-4-8(7,5-2)6-3/h7H,4-6H2,1-3H3 None | Legacy Database |
| cas-inchi-key | InChIKey=WVMSIBFANXCZKT-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Triethylsilanol None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 39.415800000000004 | RDKit |
