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Lithium Metaphosphate
CAS: 13762-75-9 | HLiO3P
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13762-75-9
Molecular Formula:
HLiO3P
Molecular Mass:
86.92 g/mol
Names and Synonyms:
Lithium Metaphosphate
Metaphosphoric acid (HPO3), lithium salt
Lithium metaphosphate (LiPO3)
Lithium phosphate (LiPO3)
Lithium polymetaphosphate
Lithium metaphosphate
Identifiers:
SMILES:
O=P(=O)O.[Li]
InChI:
InChI=1S/Li.HO3P/c;1-4(2)3/h;(H,1,2,3)
Key Properties
Melting Point
656 °C
CAS Common Chemistry
Density
2.73 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 | 86.92 g/mol | CAS Common Chemistry |
| 86.98233507200001 g/mol | RDKit | |
| Density | 2.73 g/cm³ | CAS Common Chemistry |
| 2.73 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | [Li].O=P(=O)O | CAS Common Chemistry |
| InChI | InChI=1S/Li.HO3P/c;1-4(2)3/h;(H,1,2,3) | CAS Common Chemistry |
| InChI Key | InChIKey=AKZOYHUYFBJCSM-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 656 °C | CAS Common Chemistry |
| Name | Lithium metaphosphate | CAS Common Chemistry |
| Heavy Atom Count | 5 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 54.370000000000005 Ų | RDKit |
| LogP | -0.3142000000000001 | RDKit |
| Molar Refractivity | 16.2658 | RDKit |
