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Chlorodimethylpropylsilane
CAS: 17477-29-1 | C5H13ClSi
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
17477-29-1
Molecular Formula:
C5H13ClSi
Molecular Mass:
136.70 g/mol
Names and Synonyms:
Chlorodimethylpropylsilane
Silane, chlorodimethylpropyl-
Chlorodimethylpropylsilane
Propyl(dimethyl)chlorosilane
Dimethylpropylsilyl chloride
Dimethyl-n-propylchlorosilane
Identifiers:
SMILES:
CCC[Si](C)(C)Cl
InChI:
InChI=1S/C5H13ClSi/c1-4-5-7(2,3)6/h4-5H2,1-3H3
Key Properties
Boiling Point
113-114 °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 | 136.70 g/mol | CAS Common Chemistry |
| 136.69799999999998 g/mol | RDKit | |
| 136.047504626 g/mol | RDKit | |
| Density | 0.87 g/cm³ | CAS Common Chemistry |
| 0.872 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 113-114 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Si](C)(C)CCC | CAS Common Chemistry |
| InChI | InChI=1S/C5H13ClSi/c1-4-5-7(2,3)6/h4-5H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=HXVPUKPVLPTVCQ-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Chlorodimethylpropylsilane | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 0 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 2 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 0.0 Ų | RDKit |
| LogP | 2.840300000000001 | RDKit |
| Molar Refractivity | 38.43300000000001 | RDKit |
