Back to Search
Dodecyldimethylchlorosilane
CAS: 66604-31-7 | C14H31ClSi
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
66604-31-7
Molecular Formula:
C14H31ClSi
Molecular Mass:
262.94 g/mol
Names and Synonyms:
Dodecyldimethylchlorosilane
Silane, chlorododecyldimethyl-
Chlorododecyldimethylsilane
Dimethyl(dodecyl)chlorosilane
n-Dodecyldimethylchlorosilane
Dodecyldimethylchlorosilane
Dimethyl-n-dodecylchlorosilane
Chlorodimethyldodecylsilane
Dimethyldodecylsilyl chloride
Dodecyldimethylsilyl chloride
1-Dodecyldimethylchlorosilane
Identifiers:
SMILES:
CCCCCCCCCCCC[Si](C)(C)Cl
InChI:
InChI=1S/C14H31ClSi/c1-4-5-6-7-8-9-10-11-12-13-14-16(2,3)15/h4-14H2,1-3H3
Key Properties
Boiling Point
291-293 °C
CAS Common Chemistry
Density
0.87 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 | 262.94 g/mol | CAS Common Chemistry |
| 262.9409999999999 g/mol | RDKit | |
| 262.188355202 g/mol | RDKit | |
| Density | 0.87 g/cm³ | CAS Common Chemistry |
| 0.865 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 291-293 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Si](C)(C)CCCCCCCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C14H31ClSi/c1-4-5-6-7-8-9-10-11-12-13-14-16(2,3)15/h4-14H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=DLLABNOCKQMTEJ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Dodecyldimethylchlorosilane | CAS Common Chemistry |
| Heavy Atom Count | 16 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 11 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 6.351200000000007 | RDKit |
| Molar Refractivity | 79.98600000000006 | RDKit |
