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Magnesium Methoxide
CAS: 109-88-6 | CH4MgO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
109-88-6
Molecular Formula:
CH4MgO
Molecular Weight:
56.347 g/mol
Names and Synonyms:
Magnesium Methoxide
Synonym
Methanol, magnesium salt (2:1)
Synonym
Magnesium methoxide
Synonym
Methanol, magnesium salt
Synonym
Magnesium dimethoxide
Synonym
Magnesium methylate
Synonym
Dimethoxymagnesium
Synonym
Bis(methoxy)magnesium
Synonym
Identifiers:
SMILES:
CO.[Mg]
InChI:
InChI=1S/CH4O.Mg/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
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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20
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| 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
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 56.347 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 56.011256448 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 |
Physical Properties
| Property | Value | Source |
|---|---|---|
| LogP | -0.7723 | RDKit |
| molecular_mass | 56.35 g/mol | Legacy Database |
| density | 0.82 g/cm³ | Legacy Database |
| cas-canonical-smile | [Mg].OC None | Legacy Database |
| cas-density | 0.815 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/CH4O.Mg/c1-2;/h2H,1H3; None | Legacy Database |
| cas-inchi-key | InChIKey=TZNULHNPXDZANP-UHFFFAOYSA-N None | Legacy Database |
| cas-name | Magnesium methoxide None | Legacy Database |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 13.8968 | RDKit |