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Lithium Methoxide
CAS: 865-34-9 | CH4LiO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
865-34-9
Molecular Formula:
CH4LiO
Molecular Weight:
38.983000000000004 g/mol
Names and Synonyms:
Lithium Methoxide
Common Name
Lithium methanolate
Synonym
Methoxylithium
Synonym
Lithium methylate
Synonym
Lithium methoxide
Synonym
Methanol, lithium salt
Synonym
Methanol, lithium salt (1:1)
Synonym
Identifiers:
SMILES:
CO.[Li]
InChI:
InChI=1S/CH4O.Li/c1-2;/h2H,1H3;
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
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120
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20
0 ppm
| Shift (ppm) | DEPT | Assignment |
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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 |
|---|---|---|
| cas-melting-point | 500 °C (decomp) None | Legacy Database |
| cas-name | Lithium methoxide None | Legacy Database |
| wikipedia-name | Lithium methoxide None | Legacy Database |
| molecular_mass | 38.98 g/mol | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Lithium_methoxide None | Legacy Database |
| cas-canonical-smile | [Li].OC None | Legacy Database |
| cas-inchi | InChI=1S/CH4O.Li/c1-2;/h2H,1H3; None | Legacy Database |
| cas-inchi-key | InChIKey=GLXCXYZWVRLFFY-UHFFFAOYSA-N None | Legacy Database |
| LogP | -0.7723 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 38.983000000000004 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 39.042219298 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 | 1 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 | 20.23 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 13.8968 | RDKit |