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Aluminium Triethoxide
CAS: 555-75-9 | C2H6AlO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
555-75-9
Molecular Formula:
C2H6AlO
Molecular Mass:
73.05 g/mol
Names and Synonyms:
Aluminium Triethoxide
Ethanol, aluminum salt (3:1)
Aluminum ethoxide
Ethyl alcohol, aluminum salt
Ethanol, aluminum salt
Aluminum ethylate
Triethoxyaluminum
Aluminum triethoxide
Aluminum triethylate
Tris(ethanolato)aluminum
Aluminum ethanolate
Aluminum, triethoxy-
Identifiers:
SMILES:
CCO.[Al]
InChI:
InChI=1S/C2H6O.Al/c1-2-3;/h3H,2H2,1H3;
Key Properties
Boiling Point
175-180 °C @ Press: 3 Torr
CAS Common Chemistry
Melting Point
157-159 °C
CAS Common Chemistry
Density
1.14 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 | 73.05 g/mol | CAS Common Chemistry |
| 73.051 g/mol | RDKit | |
| 73.023403442 g/mol | RDKit | |
| Density | 1.14 g/cm³ | CAS Common Chemistry |
| 1.142 g/cm3 @ Temp: 20 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Aluminium_triethoxide | CAS Common Chemistry |
| Boiling Point | 175-180 °C @ Press: 3 Torr | CAS Common Chemistry |
| Canonical SMILES | [Al].OCC | CAS Common Chemistry |
| InChI | InChI=1S/C2H6O.Al/c1-2-3;/h3H,2H2,1H3; | CAS Common Chemistry |
| InChI Key | InChIKey=LIYILTXDOBZLIO-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 157-159 °C | CAS Common Chemistry |
| Name | Aluminum ethoxide | CAS Common Chemistry |
| Aluminium triethoxide | CAS Common Chemistry | |
| Heavy Atom Count | 4 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 20.23 Ų | RDKit |
| LogP | -0.38220000000000004 | RDKit |
| Molar Refractivity | 18.5138 | RDKit |
