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Aluminium Isopropoxide
CAS: 555-31-7 | C3H8AlO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
555-31-7
Molecular Formula:
C3H8AlO
Molecular Mass:
87.08 g/mol
Names and Synonyms:
Aluminium Isopropoxide
2-Propanol, aluminum salt (3:1)
2-Propanol, aluminum salt
Isopropyl alcohol, aluminum salt
Aluminum isopropoxide
Aluminum isopropylate
Aluminum triisopropoxide
Triisopropoxyaluminum
Aluminum triisopropylate
Aliso
Aluminum isopropanolate
Aluminium isopropoxide
Aluminum sec-propanolate
Isopropanol aluminum salt
Aluminum tris(sec-propoxide)
Triisopropyloxyaluminum
Tris(isopropoxy)aluminum
Aluminum 2-propoxide
Aluminum isopropoxide (1:3)
Aluminum tris(isopropoxide)
Aluminum isopropylate (Al(OC3H7)3)
AIPD
Aluminum(3+) isopropoxide
Aluminum tris(iso-propoxide)
Manalox 130
Triisopropyl aluminate
PADM
Aluminum tris(isopropylate)
Aluminum isopropioate
Tris(isopropanolato)aluminum
SYM-AL 04
A 1010
Identifiers:
SMILES:
CC(C)O.[Al]
InChI:
InChI=1S/C3H8O.Al/c1-3(2)4;/h3-4H,1-2H3;
Key Properties
Boiling Point
94 °C @ Press: 0.5 Torr
CAS Common Chemistry
Melting Point
119 °C
CAS Common Chemistry
Density
1.03 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 | 87.08 g/mol | CAS Common Chemistry |
| 87.078 g/mol | RDKit | |
| 87.039053506 g/mol | RDKit | |
| Density | 1.03 g/cm³ | CAS Common Chemistry |
| 1.025 g/cm3 @ Temp: 20 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Aluminium_isopropoxide | CAS Common Chemistry |
| Boiling Point | 94 °C @ Press: 0.5 Torr | CAS Common Chemistry |
| Canonical SMILES | [Al].OC(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C3H8O.Al/c1-3(2)4;/h3-4H,1-2H3; | CAS Common Chemistry |
| InChI Key | InChIKey=XHODMTAOVMFHQJ-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 119 °C | CAS Common Chemistry |
| Name | Aluminum isopropoxide | CAS Common Chemistry |
| Aluminium isopropoxide | CAS Common Chemistry | |
| Heavy Atom Count | 5 | 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 | 0.006300000000000028 | RDKit |
| Molar Refractivity | 23.10879999999999 | RDKit |
