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Molecule
(Chloromethyl)Diethoxymethylsilane
CAS: 2212-10-4 · C6H15ClO2Si
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 2212-10-4
- Molecular Formula
- C6H15ClO2Si
- Molecular Mass
- 182.72 g/mol
Identifiers
CAS Registry Number
2212-10-4
SMILES
CCO[Si](C)(CCl)OCC
InChI Key
XGLLBUISUZEUMW-UHFFFAOYSA-N
InChI
InChI=1S/C6H15ClO2Si/c1-4-8-10(3,6-7)9-5-2/h4-6H2,1-3H3
Names and Synonyms
- (Chloromethyl)Diethoxymethylsilane Common Name
- Silane, (chloromethyl)diethoxymethyl- Synonym
- (Chloromethyl)diethoxymethylsilane Synonym
- (Chloromethyl)methyldiethoxysilane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 182.72 g/mol | CAS Common Chemistry |
| 182.72299999999996 g/mol | RDKit | |
| 182.723 g/mol | RDKit | |
| Density | 1.00 g/cm³ | CAS Common Chemistry |
| 1 g/cm3 @ 25 °C | CAS Common Chemistry | |
| Boiling Point | 160-161 °C | CAS Common Chemistry |
| Canonical SMILES | ClC[Si](OCC)(OCC)C | CAS Common Chemistry |
| InChI | InChI=1S/C6H15ClO2Si/c1-4-8-10(3,6-7)9-5-2/h4-6H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=XGLLBUISUZEUMW-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | (Chloromethyl)diethoxymethylsilane | CAS Common Chemistry |
| Heavy Atom Count | 10 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 5 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 18.46 Ų | RDKit |
| LogP | 1.9094 | RDKit |
| Molar Refractivity | 45.590000000000025 cm³/mol | RDKit |
| Ring Count | 0 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 1.0 | RDKit |
| Exact Mass | 182.05298392999998 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
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.
External Resources
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MW = 182.72 g/mol; density = 1.000 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C6H15ClO2Si.
