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Magnesium, Chloro[(Trimethylsilyl)Methyl]-
CAS: 13170-43-9 | C4H11ClMgSi
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
13170-43-9
Molecular Formula:
C4H11ClMgSi
Molecular Weight:
146.976 g/mol
Names and Synonyms:
Magnesium, Chloro[(Trimethylsilyl)Methyl]-
Chloro(trimethylsilylmethyl)magnesium
[(Trimethylsilyl)methyl]magnesium chloride
Magnesium, chloro[(trimethylsilyl)methyl]-
Identifiers:
SMILES:
[CH2][Si](C)(C)C.[Cl-].[Mg+]
InChI:
InChI=1S/C4H11Si.ClH.Mg/c1-5(2,3)4;;/h1H2,2-4H3;1H;/q;;+1/p-1
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
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 146.98 g/mol | Legacy Database |
| density | 0.78 g/cm³ | Legacy Database |
| cas-canonical-smile | Cl[Mg]C[Si](C)(C)C None | Legacy Database |
| cas-density | 0.777 g/cm3 None | Legacy Database |
| cas-inchi | InChI=1S/C4H11Si.ClH.Mg/c1-5(2,3)4;;/h1H2,2-4H3;1H;/q;;+1/p-1 None | Legacy Database |
| cas-inchi-key | InChIKey=NAQATMJWCJCHOZ-UHFFFAOYSA-M None | Legacy Database |
| cas-name | Magnesium, chloro[(trimethylsilyl)methyl]- None | Legacy Database |
| cas-melting-point | 105.8-106.4 °C None | Legacy Database |
| LogP | -1.6789099999999981 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 146.976 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 146.016896262 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 7 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 | 0.0 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 34.456999999999994 | RDKit |
