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Molecule
Phosphorodifluoridic Acid, Lithium Salt (1:1)
CAS: 24389-25-1 · HF2LiO2P
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 24389-25-1
- Molecular Formula
- HF2LiO2P
- Molecular Mass
- 108.92 g/mol
Identifiers
CAS Registry Number
24389-25-1
SMILES
O=P(O)(F)F.[Li]
InChI Key
YSNLHLJYEBEKMC-UHFFFAOYSA-N
InChI
InChI=1S/F2HO2P.Li/c1-5(2,3)4;/h(H,3,4);
Names and Synonyms
- Phosphorodifluoridic Acid, Lithium Salt (1:1) Synonym
- Phosphorodifluoridic acid, lithium salt (1:1) Synonym
- Phosphorodifluoridic acid, lithium salt Synonym
- Lithium phosphorodifluoridate Synonym
- Lithium difluorophosphate Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 108.92 g/mol | CAS Common Chemistry |
| 108.91700000000002 g/mol | RDKit | |
| 108.98422689200001 g/mol | RDKit | |
| 109.925 g/mol | chempirical lib | |
| Canonical SMILES | [Li].O=P(F)(F)O | CAS Common Chemistry |
| InChI | InChI=1S/F2HO2P.Li/c1-5(2,3)4;/h(H,3,4); | CAS Common Chemistry |
| InChI Key | InChIKey=YSNLHLJYEBEKMC-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Phosphorodifluoridic acid, lithium salt (1:1) | CAS Common Chemistry |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 37.3 Ų | RDKit |
| LogP | 0.6449999999999998 | RDKit |
| 0.645 | RDKit | |
| Molar Refractivity | 17.7953 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.0 | RDKit |
| Exact Mass | 108.917 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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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 = 108.92 g/mol. Edit any field — others recompute live.
