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Lithium Cobalt Oxide
CAS: 12190-79-3 | CoLiO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
12190-79-3
Molecular Formula:
CoLiO
Molecular Weight:
81.87299999999999 g/mol
Names and Synonyms:
Lithium Cobalt Oxide
Common Name
KD 10
Synonym
Lithium cobalt oxide
Synonym
Lithium cobaltite
Synonym
Lithium cobalt(III) oxide
Synonym
Cell Seed C 20F2
Synonym
C 012
Synonym
C 5H
Synonym
Selion C
Synonym
Cobalt lithium dioxide
Synonym
Cell Seed C 10N
Synonym
Cell Seed C 2
Synonym
Cell Seed C 5H
Synonym
HLC 22
Synonym
Cell Seed 10N
Synonym
HLC 17
Synonym
D 10
Synonym
D 10 (metal oxide)
Synonym
Cell Seed C 20
Synonym
Cell Seed C 8G
Synonym
Cell Seed C 5J
Synonym
Cell Seed 5
Synonym
C 10 (metal oxide)
Synonym
C 10
Synonym
NC 5N
Synonym
HLC 21
Synonym
Cell Seed C 10
Synonym
Cell Seed C 5
Synonym
Lithium cobaltate (LiCoO2)
Synonym
Lithium cobalt oxide (LiCoO2)
Synonym
Lithium cobaltate(III) (LiCoO2)
Synonym
Cobaltate (CoO21-), lithium
Synonym
Cobalt lithium oxide (LiCoO2)
Synonym
Cobalt lithium oxide (CoLiO2)
Synonym
Identifiers:
SMILES:
[Co].[Li].[O]
InChI:
InChI=1S/Co.Li.O
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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 81.87299999999999 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 81.94411417 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 3 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 0 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 | 28.5 Ų | RDKit |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -0.5021 | RDKit |
| molecular_mass | 81.87 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Lithium_cobalt_oxide None | Legacy Database |
| cas-canonical-smile | [Li].[O].[Co] None | Legacy Database |
| cas-density | 2.0-2.6 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/Co.Li.O None | Legacy Database |
| cas-inchi-key | InChIKey=IDSMHEZTLOUMLM-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Cobalt lithium oxide (CoLiO2) None | Legacy Database |
| wikipedia-name | Lithium cobalt oxide None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 6.440499999999999 | RDKit |