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Molecule
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 Mass
- 56.35 g/mol
Identifiers
CAS Registry Number
109-88-6
SMILES
CO.[Mg]
InChI Key
TZNULHNPXDZANP-UHFFFAOYSA-N
InChI
InChI=1S/CH4O.Mg/c1-2;/h2H,1H3;
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
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 56.35 g/mol | CAS Common Chemistry |
| 56.347 g/mol | RDKit | |
| 58.363 g/mol | chempirical lib | |
| Density | 0.82 g/cm³ | CAS Common Chemistry |
| 0.815 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | [Mg].OC | CAS Common Chemistry |
| InChI | InChI=1S/CH4O.Mg/c1-2;/h2H,1H3; | CAS Common Chemistry |
| InChI Key | InChIKey=TZNULHNPXDZANP-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Magnesium methoxide | CAS Common Chemistry |
| Heavy Atom Count | 3 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 20.23 Ų | RDKit |
| LogP | -0.7723 | RDKit |
| Molar Refractivity | 13.8968 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 56.011256448 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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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.
External Resources
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Quick conversion
MW = 56.35 g/mol; density = 0.820 g/mL. Edit any field — others recompute live.
