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Hexachlorodisiloxane
CAS: 14986-21-1 | Cl6OSi2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
14986-21-1
Molecular Formula:
Cl6OSi2
Molecular Mass:
284.89 g/mol
Names and Synonyms:
Hexachlorodisiloxane
Disiloxane, 1,1,1,3,3,3-hexachloro-
Disiloxane, hexachloro-
1,1,1,3,3,3-Hexachlorodisiloxane
Hexachlorodisiloxane
Silicon chloride oxide (Si2OCl6)
Silicon oxychloride (Si2OCl6)
Trichloro(trichlorosiloxo)silane
Bis(trichlorosilyl) oxide
Bis(trichlorosilyl) ether
Perchlorodisiloxane
Identifiers:
SMILES:
Cl[Si](Cl)(Cl)O[Si](Cl)(Cl)Cl
InChI:
InChI=1S/Cl6OSi2/c1-8(2,3)7-9(4,5)6
Key Properties
Boiling Point
137 °C
CAS Common Chemistry
Melting Point
-33 °C
CAS Common Chemistry
Density
1.58 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 | 284.89 g/mol | CAS Common Chemistry |
| 284.889 g/mol | RDKit | |
| 281.76188376 g/mol | RDKit | |
| Density | 1.58 g/cm³ | CAS Common Chemistry |
| 1.575 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 137 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Si](Cl)(Cl)O[Si](Cl)(Cl)Cl | CAS Common Chemistry |
| InChI | InChI=1S/Cl6OSi2/c1-8(2,3)7-9(4,5)6 | CAS Common Chemistry |
| InChI Key | InChIKey=QHAHOIWVGZZELU-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -33 °C | CAS Common Chemistry |
| Name | Hexachlorodisiloxane | CAS Common Chemistry |
| Heavy Atom Count | 9 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 9.23 Ų | RDKit |
| LogP | 3.3069999999999995 | RDKit |
| Molar Refractivity | 47.711000000000006 | RDKit |
