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Chlorodimethyloctylsilane
CAS: 18162-84-0 | C10H23ClSi
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
18162-84-0
Molecular Formula:
C10H23ClSi
Molecular Mass:
206.83 g/mol
Names and Synonyms:
Chlorodimethyloctylsilane
Silane, chlorodimethyloctyl-
LS 3490
Chlorodimethyloctylsilane
n-Octyldimethylchlorosilane
Octyldimethylchlorosilane
Dimethyl(octyl)silyl chloride
Dimethyloctylchlorosilane
Dimethyl-n-octylchlorosilane
ODMCS
Identifiers:
SMILES:
CCCCCCCC[Si](C)(C)Cl
InChI:
InChI=1S/C10H23ClSi/c1-4-5-6-7-8-9-10-12(2,3)11/h4-10H2,1-3H3
Key Properties
Boiling Point
222-225 °C
CAS Common Chemistry
Density
0.79 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 | 206.83 g/mol | CAS Common Chemistry |
| 206.833 g/mol | RDKit | |
| 206.125754946 g/mol | RDKit | |
| Density | 0.79 g/cm³ | CAS Common Chemistry |
| 0.794 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 222-225 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Si](C)(C)CCCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C10H23ClSi/c1-4-5-6-7-8-9-10-12(2,3)11/h4-10H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=DBKNGKYVNBJWHL-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Chlorodimethyloctylsilane | CAS Common Chemistry |
| Heavy Atom Count | 12 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 7 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 4.790800000000004 | RDKit |
| Molar Refractivity | 61.51800000000006 | RDKit |
