Back to Search
Lithium Hydroxide, Monohydrate
CAS: 1310-66-3 | H3LiO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1310-66-3
Molecular Formula:
H3LiO2
Molecular Weight:
41.963 g/mol
Names and Synonyms:
Lithium Hydroxide, Monohydrate
Common Name
Lithium hydroxide hydrate
Synonym
Lithium hydroxide, monohydrate
Synonym
Lithium hydroxide (Li(OH)), monohydrate
Synonym
Identifiers:
SMILES:
O.[Li+].[OH-]
InChI:
InChI=1S/Li.2H2O/h;2*1H2/q+1;;/p-1
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 41.96 g/mol | Legacy Database |
| density | 1.51 g/cm³ | Legacy Database |
| cas-canonical-smile | [Li]O.O None | Legacy Database |
| cas-density | 1.51 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/Li.2H2O/h;2*1H2/q+1;;/p-1 None | Legacy Database |
| cas-inchi-key | InChIKey=GLXDVVHUTZTUQK-UHFFFAOYSA-M None | Legacy Database |
| cas-melting-point | 450 °C None | Legacy Database |
| cas-name | Lithium hydroxide, monohydrate None | Legacy Database |
| LogP | -3.9974999999999996 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 41.963 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 42.029308886 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 3 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 1 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 0 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 61.5 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 5.5496 | RDKit |