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Molecule
(Dodecyl)(Methyl)Dichlorosilane
CAS: 18407-07-3 · C13H28Cl2Si
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 18407-07-3
- Molecular Formula
- C13H28Cl2Si
- Molecular Mass
- 283.36 g/mol
Identifiers
CAS Registry Number
18407-07-3
SMILES
CCCCCCCCCCCC[Si](C)(Cl)Cl
InChI Key
ZAADUWCLWTWDSZ-UHFFFAOYSA-N
InChI
InChI=1S/C13H28Cl2Si/c1-3-4-5-6-7-8-9-10-11-12-13-16(2,14)15/h3-13H2,1-2H3
Names and Synonyms
- (Dodecyl)(Methyl)Dichlorosilane Common Name
- Silane, dichlorododecylmethyl- Synonym
- Dichlorododecylmethylsilane Synonym
- Dichloro(dodecyl)methylsilane Synonym
- (Dodecyl)(methyl)dichlorosilane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 283.36 g/mol | CAS Common Chemistry |
| 283.3589999999999 g/mol | RDKit | |
| 283.359 g/mol | RDKit | |
| 283.353 g/mol | chempirical lib | |
| Density | 0.96 g/cm³ | CAS Common Chemistry |
| 0.955 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | Cl[Si](Cl)(C)CCCCCCCCCCCC | CAS Common Chemistry |
| InChI | InChI=1S/C13H28Cl2Si/c1-3-4-5-6-7-8-9-10-11-12-13-16(2,14)15/h3-13H2,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=ZAADUWCLWTWDSZ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | (Dodecyl)(methyl)dichlorosilane | 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 | 6.456900000000005 | RDKit |
| 6.4569 | RDKit | |
| 6.7 | chempirical lib | |
| Molar Refractivity | 79.97500000000007 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 282.133732786 g/mol | RDKit |
| Boiling Point | 124-127 °C @ 3 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
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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 = 283.36 g/mol; density = 0.960 g/mL. Edit any field — others recompute live.
