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Dichloromethyl-2-Propen-1-Ylsilane
CAS: 1873-92-3 | C4H8Cl2Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
1873-92-3
Molecular Formula:
C4H8Cl2Si
Molecular Mass:
155.10 g/mol
Names and Synonyms:
Dichloromethyl-2-Propen-1-Ylsilane
Silane, dichloromethyl-2-propen-1-yl-
Silane, allyldichloromethyl-
Silane, dichloromethyl-2-propenyl-
Dichloromethyl-2-propen-1-ylsilane
Allyldichloromethylsilane
Allylmethyldichlorosilane
Identifiers:
SMILES:
C=CC[Si](C)(Cl)Cl
InChI:
InChI=1S/C4H8Cl2Si/c1-3-4-7(2,5)6/h3H,1,4H2,2H3
Key Properties
Boiling Point
119.5 °C
CAS Common Chemistry
Density
1.08 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 | 155.10 g/mol | CAS Common Chemistry |
| 155.1 g/mol | RDKit | |
| 153.977232146 g/mol | RDKit | |
| Density | 1.08 g/cm³ | CAS Common Chemistry |
| 1.076 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 119.5 °C | CAS Common Chemistry |
| Canonical SMILES | Cl[Si](Cl)(C)CC=C | CAS Common Chemistry |
| InChI | InChI=1S/C4H8Cl2Si/c1-3-4-7(2,5)6/h3H,1,4H2,2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=YCEQUKAYVABWTE-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | Dichloromethyl-2-propen-1-ylsilane | 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 | 2.7220000000000004 | RDKit |
| Molar Refractivity | 38.32800000000001 | RDKit |
