Back to Search
Dibutyldichlorosilane
CAS: 3449-28-3 | C8H18Cl2Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
3449-28-3
Molecular Formula:
C8H18Cl2Si
Molecular Mass:
213.22 g/mol
Names and Synonyms:
Dibutyldichlorosilane
Silane, dibutyldichloro-
Dibutyldichlorosilane
LS 2250
Identifiers:
SMILES:
CCCC[Si](Cl)(Cl)CCCC
InChI:
InChI=1S/C8H18Cl2Si/c1-3-5-7-11(9,10)8-6-4-2/h3-8H2,1-2H3
Key Properties
Boiling Point
62-63.5 °C @ Press: 4.5 Torr
CAS Common Chemistry
Density
0.99 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 |
| 213.22399999999996 g/mol | RDKit | |
| 212.055482466 g/mol | RDKit | |
| Density | 0.99 g/cm³ | CAS Common Chemistry |
| 0.9915 g/cm3 @ Temp: 20 °C | CAS Common Chemistry | |
| Name | Dibutyldichlorosilane | CAS Common Chemistry |
| InChI | InChI=1S/C8H18Cl2Si/c1-3-5-7-11(9,10)8-6-4-2/h3-8H2,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=NJKDOKBDBHYMAH-UHFFFAOYSA-N | CAS Common Chemistry |
| Boiling Point | 62-63.5 °C @ Press: 4.5 Torr | CAS Common Chemistry |
| Canonical SMILES | Cl[Si](Cl)(CCCC)CCCC | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 6 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 4.506400000000004 | RDKit |
| Molar Refractivity | 56.89000000000004 | RDKit |
