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Methyldichlorosilane
CAS: 75-54-7 | CH4Cl2Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
75-54-7
Molecular Formula:
CH4Cl2Si
Molecular Mass:
115.04 g/mol
Names and Synonyms:
Methyldichlorosilane
Silane, dichloromethyl-
Methylsilicon dichloride
Dichloromethylsilane
Methyldichlorosilane
Dichlorohydridomethylsilicon
Monomethyldichlorosilane
LS 50
Methylhydrodichlorosilane
Identifiers:
SMILES:
C[SiH](Cl)Cl
InChI:
InChI=1S/CH4Cl2Si/c1-4(2)3/h4H,1H3
Key Properties
Boiling Point
41 °C
CAS Common Chemistry
Melting Point
-93 °C
CAS Common Chemistry
Density
1.10 g/cm³
CAS Common Chemistry
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
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 115.04 g/mol | CAS Common Chemistry |
| 115.035 g/mol | RDKit | |
| 113.945932018 g/mol | RDKit | |
| Density | 1.10 g/cm³ | CAS Common Chemistry |
| 1.10 g/cm3 @ Temp: 27 °C | CAS Common Chemistry | |
| Boiling Point | 41 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[SiH](Cl)C | CAS Common Chemistry |
| InChI | InChI=1S/CH4Cl2Si/c1-4(2)3/h4H,1H3 | CAS Common Chemistry |
| InChI Key | InChIKey=NWKBSEBOBPHMKL-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -93 °C | CAS Common Chemistry |
| Name | Methyldichlorosilane | CAS Common Chemistry |
| Heavy Atom Count | 4 | 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 | 1.3143 | RDKit |
| Molar Refractivity | 24.718999999999994 | RDKit |
