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Trichloro(Dichloromethyl)Silane
CAS: 1558-24-3 | CHCl5Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1558-24-3
Molecular Formula:
CHCl5Si
Molecular Mass:
218.37 g/mol
Names and Synonyms:
Trichloro(Dichloromethyl)Silane
Silane, trichloro(dichloromethyl)-
Trichloro(dichloromethyl)silane
(Dichloromethyl)trichlorosilane
NSC 139833
Identifiers:
SMILES:
ClC(Cl)[Si](Cl)(Cl)Cl
InChI:
InChI=1S/CHCl5Si/c2-1(3)7(4,5)6/h1H
Key Properties
Boiling Point
145 °C
CAS Common Chemistry
Density
1.55 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 | 218.37 g/mol | CAS Common Chemistry |
| 215.829014962 g/mol | RDKit | |
| Density | 1.55 g/cm³ | CAS Common Chemistry |
| 1.5518 g/cm3 @ Temp: 20 °C | CAS Common Chemistry | |
| Boiling Point | 145 °C | CAS Common Chemistry |
| Canonical SMILES | ClC(Cl)[Si](Cl)(Cl)Cl | CAS Common Chemistry |
| InChI | InChI=1S/CHCl5Si/c2-1(3)7(4,5)6/h1H | CAS Common Chemistry |
| InChI Key | InChIKey=LQUJCRPJNSUWKY-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Trichloro(dichloromethyl)silane | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 2.9846000000000004 | RDKit |
| Molar Refractivity | 38.807 | RDKit |
