Back to Search
(Chloromethyl)Trimethoxysilane
CAS: 5926-26-1 | C4H11ClO3Si
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
5926-26-1
Molecular Formula:
C4H11ClO3Si
Molecular Mass:
170.67 g/mol
Names and Synonyms:
(Chloromethyl)Trimethoxysilane
Silane, (chloromethyl)trimethoxy-
(Chloromethyl)trimethoxysilane
Trimethoxy(chloromethyl)silane
Chloro(trimethoxysilyl)methane
Identifiers:
SMILES:
CO[Si](CCl)(OC)OC
InChI:
InChI=1S/C4H11ClO3Si/c1-6-9(4-5,7-2)8-3/h4H2,1-3H3
Key Properties
Boiling Point
156 °C
CAS Common Chemistry
Density
1.13 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 | 170.67 g/mol | CAS Common Chemistry |
| 170.668 g/mol | RDKit | |
| 170.01659842200002 g/mol | RDKit | |
| Density | 1.13 g/cm³ | CAS Common Chemistry |
| 1.125 g/cm3 | CAS Common Chemistry | |
| Boiling Point | 156 °C | CAS Common Chemistry |
| Canonical SMILES | ClC[Si](OC)(OC)OC | CAS Common Chemistry |
| InChI | InChI=1S/C4H11ClO3Si/c1-6-9(4-5,7-2)8-3/h4H2,1-3H3 | CAS Common Chemistry |
| InChI Key | InChIKey=FPOSCXQHGOVVPD-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | (Chloromethyl)trimethoxysilane | CAS Common Chemistry |
| Heavy Atom Count | 9 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 27.69 Ų | RDKit |
| LogP | 0.6424999999999998 | RDKit |
| Molar Refractivity | 37.501000000000005 | RDKit |
