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Molecule
Chlorodimethyloctylsilane
CAS: 18162-84-0 · C10H23ClSi
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 18162-84-0
- Molecular Formula
- C10H23ClSi
- Molecular Mass
- 206.83 g/mol
Identifiers
CAS Registry Number
18162-84-0
SMILES
CCCCCCCC[Si](C)(C)Cl
InChI Key
DBKNGKYVNBJWHL-UHFFFAOYSA-N
InChI
InChI=1S/C10H23ClSi/c1-4-5-6-7-8-9-10-12(2,3)11/h4-10H2,1-3H3
Names and Synonyms
- Chlorodimethyloctylsilane Synonym
- Silane, chlorodimethyloctyl- Synonym
- LS 3490 Synonym
- Chlorodimethyloctylsilane Synonym
- n-Octyldimethylchlorosilane Synonym
- Octyldimethylchlorosilane Synonym
- Dimethyl(octyl)silyl chloride Synonym
- Dimethyloctylchlorosilane Synonym
- Dimethyl-n-octylchlorosilane Synonym
- ODMCS Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 206.83 g/mol | CAS Common Chemistry |
| 206.833 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 |
| 4.7908 | RDKit | |
| 4.96 | chempirical lib | |
| Molar Refractivity | 61.51800000000006 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 206.125754946 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
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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.
External Resources
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MW = 206.83 g/mol; density = 0.790 g/mL. Edit any field — others recompute live.
