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1,1′-(1,2-Ethanediyl)Bis[1,1,1-Trichlorosilane]
CAS: 2504-64-5 | C2H4Cl6Si2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
2504-64-5
Molecular Formula:
C2H4Cl6Si2
Molecular Mass:
296.94 g/mol
Names and Synonyms:
1,1′-(1,2-Ethanediyl)Bis[1,1,1-Trichlorosilane]
Silane, 1,1′-(1,2-ethanediyl)bis[1,1,1-trichloro-
1,4-Disilabutane, 1,1,1,4,4,4-hexachloro-
Silane, 1,2-ethanediylbis[trichloro-
1,1′-(1,2-Ethanediyl)bis[1,1,1-trichlorosilane]
1,2-Bis(trichlorosilyl)ethane
Ethylenebis(trichlorosilane)
1,2-Ethanediylbis(trichlorosilane)
1,1,1,4,4,4-Hexachloro-1,4-disilabutane
Trichloro(2-trichlorosilylethyl)silane
Identifiers:
SMILES:
Cl[Si](Cl)(Cl)CC[Si](Cl)(Cl)Cl
InChI:
InChI=1S/C2H4Cl6Si2/c3-9(4,5)1-2-10(6,7)8/h1-2H2
Key Properties
Boiling Point
201 °C
CAS Common Chemistry
Melting Point
24-25 °C
CAS Common Chemistry
Density
1.48 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 | 296.94 g/mol | CAS Common Chemistry |
| 296.94399999999996 g/mol | RDKit | |
| 293.798269268 g/mol | RDKit | |
| Density | 1.48 g/cm³ | CAS Common Chemistry |
| 1.482 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 201 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Si](Cl)(Cl)CC[Si](Cl)(Cl)Cl | CAS Common Chemistry |
| InChI | InChI=1S/C2H4Cl6Si2/c3-9(4,5)1-2-10(6,7)8/h1-2H2 | CAS Common Chemistry |
| InChI Key | InChIKey=WDVUXWDZTPZIIE-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 24-25 °C | CAS Common Chemistry |
| Name | 1,1′-(1,2-Ethanediyl)bis[1,1,1-trichlorosilane] | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 4.297000000000001 | RDKit |
| Molar Refractivity | 56.240000000000016 | RDKit |
