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Molecule
Magnesium, Chloro[(Trimethylsilyl)Methyl]-
CAS: 13170-43-9 · C4H11ClMgSi
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 13170-43-9
- Molecular Formula
- C4H11ClMgSi
- Molecular Mass
- 146.98 g/mol
Identifiers
CAS Registry Number
13170-43-9
SMILES
[CH2][Si](C)(C)C.[Cl-].[Mg+]
InChI Key
NAQATMJWCJCHOZ-UHFFFAOYSA-M
InChI
InChI=1S/C4H11Si.ClH.Mg/c1-5(2,3)4;;/h1H2,2-4H3;1H;/q;;+1/p-1
Names and Synonyms
- Magnesium, Chloro[(Trimethylsilyl)Methyl]- Systematic Name
- Magnesium, chloro[(trimethylsilyl)methyl]- Synonym
- [(Trimethylsilyl)methyl]magnesium chloride Synonym
- Chloro(trimethylsilylmethyl)magnesium Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 146.98 g/mol | CAS Common Chemistry |
| 146.976 g/mol | RDKit | |
| 149.997 g/mol | chempirical lib | |
| Density | 0.78 g/cm³ | CAS Common Chemistry |
| 0.777 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | Cl[Mg]C[Si](C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C4H11Si.ClH.Mg/c1-5(2,3)4;;/h1H2,2-4H3;1H;/q;;+1/p-1 | CAS Common Chemistry |
| InChI Key | InChIKey=NAQATMJWCJCHOZ-UHFFFAOYSA-M | CAS Common Chemistry |
| Melting Point | 105.8-106.4 °C | CAS Common Chemistry |
| Name | Magnesium, chloro[(trimethylsilyl)methyl]- | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 0 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | -1.6789099999999981 | RDKit |
| -1.6789 | RDKit | |
| Molar Refractivity | 34.456999999999994 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.75 | RDKit |
| Exact Mass | 146.016896262 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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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.
External Resources
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MW = 146.98 g/mol; density = 0.780 g/mL. Edit any field — others recompute live.
