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Dichlorobis(1,1-Dimethylethyl)Silane
CAS: 18395-90-9 | C8H18Cl2Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
18395-90-9
Molecular Formula:
C8H18Cl2Si
Molecular Mass:
213.22 g/mol
Names and Synonyms:
Dichlorobis(1,1-Dimethylethyl)Silane
Silane, dichlorobis(1,1-dimethylethyl)-
Silane, di-tert-butyldichloro-
Dichlorobis(1,1-dimethylethyl)silane
Di-tert-butyldichlorosilane
Identifiers:
SMILES:
CC(C)(C)[Si](Cl)(Cl)C(C)(C)C
InChI:
InChI=1S/C8H18Cl2Si/c1-7(2,3)11(9,10)8(4,5)6/h1-6H3
Key Properties
Boiling Point
190-191 °C
CAS Common Chemistry
Melting Point
-15 °C
CAS Common Chemistry
Density
1.01 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 | 213.22 g/mol | CAS Common Chemistry |
| 213.224 g/mol | RDKit | |
| 212.055482466 g/mol | RDKit | |
| Density | 1.01 g/cm³ | CAS Common Chemistry |
| 1.009 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 190-191 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Si](Cl)(C(C)(C)C)C(C)(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C8H18Cl2Si/c1-7(2,3)11(9,10)8(4,5)6/h1-6H3 | CAS Common Chemistry |
| InChI Key | InChIKey=PDYPRPVKBUOHDH-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -15 °C | CAS Common Chemistry |
| Name | Dichlorobis(1,1-dimethylethyl)silane | CAS Common Chemistry |
| Heavy Atom Count | 11 | 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 | 4.506400000000004 | RDKit |
| Molar Refractivity | 56.89000000000004 | RDKit |
