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Molecule
Aluminum Potassium Fluoride
CAS: 60304-36-1 · AlFK
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 60304-36-1
- Molecular Formula
- AlFK
- Molecular Mass
- 85.08 g/mol
Identifiers
CAS Registry Number
60304-36-1
SMILES
[Al].[F].[K]
InChI Key
PSEGUDDDMCQZAK-UHFFFAOYSA-N
InChI
InChI=1S/Al.F.K
Names and Synonyms
- Aluminum Potassium Fluoride Synonym
- Aluminum potassium fluoride Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 85.08 g/mol | CAS Common Chemistry |
| 85.078 g/mol | RDKit | |
| 90.118 g/mol | chempirical lib | |
| Canonical SMILES | [F].[Al].[K] | CAS Common Chemistry |
| InChI | InChI=1S/Al.F.K | CAS Common Chemistry |
| InChI Key | InChIKey=PSEGUDDDMCQZAK-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Aluminum potassium fluoride | CAS Common Chemistry |
| Heavy Atom Count | 3 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | -0.34140000000000004 | RDKit |
| -0.3414 | RDKit | |
| Molar Refractivity | 12.616 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 84.94364853 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
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MW = 85.08 g/mol. Edit any field — others recompute live.
