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Molecule
Aluminium Diethyl Phosphinate
CAS: 225789-38-8 · C4H11AlO2P
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 225789-38-8
- Molecular Formula
- C4H11AlO2P
- Molecular Mass
- 149.09 g/mol
Identifiers
CAS Registry Number
225789-38-8
SMILES
CCP(=O)(O)CC.[Al]
InChI Key
GNQAGTIQCCWTSZ-UHFFFAOYSA-N
InChI
InChI=1S/C4H11O2P.Al/c1-3-7(5,6)4-2;/h3-4H2,1-2H3,(H,5,6);
Names and Synonyms
- Aluminium Diethyl Phosphinate Common Name
- Phosphinic acid, P,P-diethyl-, aluminum salt (3:1) Synonym
- Phosphinic acid, diethyl-, aluminum salt Synonym
- Aluminum diethylphosphinate Synonym
- Diethylphosphinic acid, aluminum salt (3:1) Synonym
- Exolit OP 930 Synonym
- OP 930 Synonym
- Exolit OP 1230 Synonym
- Exolit OP 935 Synonym
- OP 935 Synonym
- Diethylphosphinic acid aluminum salt Synonym
- Exolit OP 1240 Synonym
- OP 1230 Synonym
- Exolit 1240 Synonym
- Exolit 930 Synonym
- OP 1240 Synonym
- Aluminum tris(diethylphosphinate) Synonym
- Tris(diethylphosphinato)aluminium Synonym
- Exolit OP 1314 Synonym
- OP 1314 Synonym
- ZX-ADP 900 Synonym
- Pekoflam STC-PDR Synonym
- Exolite OP 935 Synonym
- Exolit 1312 Synonym
- Exolit 1314 Synonym
- ADP 01 Synonym
- FR-ADP 02 Synonym
- PFR-SN 3020 Synonym
- FLR 8003 Synonym
- ADP 30 Synonym
- LFR 8002 Synonym
- LFR 8001 Synonym
- LFR 8004 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 149.09 g/mol | CAS Common Chemistry |
| 149.08599999999998 g/mol | RDKit | |
| 149.086 g/mol | RDKit | |
| 152.11 g/mol | chempirical lib | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Aluminium_diethyl_phosphinate | CAS Common Chemistry |
| Canonical SMILES | [Al].O=P(O)(CC)CC | CAS Common Chemistry |
| InChI | InChI=1S/C4H11O2P.Al/c1-3-7(5,6)4-2;/h3-4H2,1-2H3,(H,5,6); | CAS Common Chemistry |
| InChI Key | InChIKey=GNQAGTIQCCWTSZ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Aluminum diethylphosphinate | CAS Common Chemistry |
| Aluminium diethyl phosphinate | CAS Common Chemistry | |
| Heavy Atom Count | 8 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 37.3 Ų | RDKit |
| LogP | 0.9158 | RDKit |
| Molar Refractivity | 36.661300000000004 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 149.031204852 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
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40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 149.09 g/mol. Edit any field — others recompute live.
